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Profile: Suzhou NeuPharma Co., Ltd. is a bio-pharmaceutical company. We mainly develop biomedical products. We offer herbal extracts & API intermediates.

1 to 50 of 75 Products/Chemicals (Click for related suppliers)  Page: [1] 2 >> Next 50 Results
• Abacavir
IUPAC Name: [(4S)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopenten-1-yl]methanol;sulfuric acid | CAS Registry Number: 136777-48-5
Synonyms: AKOS015962201, FT-0606626

Molecular Formula: C28H38N12O6SMolecular Weight: 670.743120 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 16

InChIKey: ONBGCFRRXHDVAP-RCWTXCDDSA-N

• ABACAVIR SULFATE, NON-LABELED, 98%
IUPAC Name: [(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methanol | CAS Registry Number: 136470-78-5
Synonyms: abacavir, Ziagen, CHEBI:421707, UNII-WR2TIP26VS, Epzicom, 1592U89, Abacavir (INN), ABC, (+/-)-Abacavir, {(1S-cis)-4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]cyclopent-2-en-1-yl}methanol, Abacavir [INN:BAN], AC1L9AXG, CHEMBL1380, Bio-0001, Ziagen (TM)(*Succinate salt*), NSC742406, ZINC02015928, DB01048, NCGC00164560-01, NCGC00164560-02

Molecular Formula: C14H18N6OMolecular Weight: 286.332320 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: MCGSCOLBFJQGHM-SCZZXKLOSA-N

• Aconitine
Synonyms: aconitine, CHEBI:2430, NSC56464, STOCK1N-54397, CID245005, NCI60_004380, C06091, 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate, 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate

Molecular Formula: C34H47NO11Molecular Weight: 645.737080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: XFSBVAOIAHNAPC-XTHSEXKGSA-N

• Acteoside
IUPAC Name: [(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 61276-17-3
Synonyms: Verbascoside, Kusaginin, MLS002473233, TJC 160, AIDS030638, NSC 603831, AIDS-030638, C29H36O15, NSC603831, CID5281800, LS-71509, SMR001397320, C10501, (B864379), Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-, .beta.-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl3-O-(6-deoxy-.alpha.-L-mannopyranosyl)-, 4-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate], 22323-52-0, 27625-92-9, Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-,4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C29H36O15Molecular Weight: 624.587140 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 15

InChIKey: FBSKJMQYURKNSU-ZLSOWSIRSA-N

• Alantolactone
IUPAC Name: (3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one | CAS Registry Number: 546-43-0
Synonyms: helenine, Eupatal, Alant camphor, Inula camphor, helenin, Elecampane camphor, Spectrum_000297, Spectrum2_000297, Spectrum3_001358, Spectrum4_001772, Spectrum5_000383, BSPBio_003175, KBioGR_002284, KBioSS_000777, SPECTRUM310010, NSC93131, SPBio_000234, CHEBI:2540, STOCK1N-11111, EINECS 208-899-3

Molecular Formula: C15H20O2Molecular Weight: 232.318100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PXOYOCNNSUAQNS-AGNJHWRGSA-N

• Albiflorin
Synonyms: 9-((Benzoyloxy)methyl)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-7-oxatricyclononan-8-one

Molecular Formula: C23H28O11Molecular Weight: 480.461820 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 11

InChIKey: QQUHMASGPODSIW-RPLHGOISSA-N

• Allomatrine
Synonyms: (+)-allomatrine, CHEMBL383443, MolPort-039-052-378, ZINC4196457, 1H,5H,10H-Dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one,dodecahydro-, (7aS,13aR,13bR,13cR)-

Molecular Formula: C15H24N2OMolecular Weight: 248.370 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZSBXGIUJOOQZMP-KYEXWDHISA-N

• Anhydroicaritin
IUPAC Name: 5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one | CAS Registry Number: 113558-15-9
Synonyms: Baohuoside I, 2h44, CID5488822, 3,5,7-Trihydroxy-4'-methoxyl-8-prenylflavone-3-O-rhamnopyranoside, 4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-

Molecular Formula: C27H30O10Molecular Weight: 514.521100 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: NGMYNFJANBHLKA-LVKFHIPRSA-N

• Arctigenin
IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one | CAS Registry Number: 7770-78-7
Synonyms: Arctigenen, (-)-Arctigenin, Tocris-1777, A1854_SIGMA, MEGxp0_001799, Dibenzylbutyrolactone lignanolide, ACon1_000416, CHEBI:391051, AIDS002466, AIDS-002466, C21H24O6, CID64981, ZINC01615344, NCGC00025291-01, NCGC00025291-02, LS-69358, C10545, BRD-K53523901-001-01-0, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)dihydro-3-((4-hydroxy-3-methoxyphenyl)methyl)-, (3R-trans)-, (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]dihydro-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone

Molecular Formula: C21H24O6Molecular Weight: 372.411660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: NQWVSMVXKMHKTF-JKSUJKDBSA-N

• Arctiin
IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one | CAS Registry Number: 20362-31-6
Synonyms: Arctigenin-4-glucoside, Arctiin (8CI), MEGxp0_000527, ACon1_001261, AIDS002468, NSC 315527, AIDS-002468, CID100528, NCGC00169522-01, LS-69357, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)-3-((4-(beta-D-glucopyranosyloxy)-3-methoxyphenyl)methyl)dihydro-, (3R-trans)-, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)-3-((4-(beta-D-glucopyranosyloxy)-3-methoxyphenyl)methyl)dihydro-, (3R-trans)- (9CI), 2(3H)-Furanone, 4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(b-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-, (3R,4R)-

Molecular Formula: C27H34O11Molecular Weight: 534.552260 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: XOJVHLIYNSOZOO-SWOBOCGESA-N

• Astragalin
IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | CAS Registry Number: 480-10-4
Synonyms: Astragaline, kaempferol-3-glucoside, Kaempferol 3-glucoside, Kaempferol 3-O-glucoside, Kaempferol-3-D-glucoside, Kaempferol-3-O-glucoside, Kaempferol-3-beta-monoglucoside, Kaempferol-3-beta-glucopyranoside, MEGxp0_000168, ACon1_001224, CHEBI:30200, Kaempferol 3-O-beta-D-glucoside, AIDS051935, AIDS-051935, 3,4',5,7-Tetrahydroxyflavone-3-glucoside, Kaempferol 3-O-beta-D-glucopyranoside, Kaempferol-3-O-.beta.-D-glucopyranoside, NCGC00163580-01, LS-39675, C12249

Molecular Formula: C21H20O11Molecular Weight: 448.376900 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 11

InChIKey: JPUKWEQWGBDDQB-QSOFNFLRSA-N

• Atorvastatin Calcium
IUPAC Name: calcium (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate | CAS Registry Number: 134523-03-8
Synonyms: Lipitor, atorvastatin, Prevencor, Lipibec, Torvast, Caduet, Sortis, Tahor, Mixture Name, ATORVASTATIN CALCIUM, Lipitor (TN), Atorvastatin calcium salt, Atorvastatin calcium [USAN], Atorvastatin calcium (USAN), 2C33H34FN2O5.Ca, CI-981, DRG-0321, CHEBI:50686, BB_SC-4721, YM-548

Molecular Formula: C66H68CaF2N4O10Molecular Weight: 1155.341726 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 14

InChIKey: FQCKMBLVYCEXJB-MNSAWQCASA-L

• Bergenin
IUPAC Name: (2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-6-one | CAS Registry Number: 477-90-7
Synonyms: bergenin, Bergenin (JAN), Bergenin [JAN], MLS001213180, AIDS031337, BB_NC-1749, AIDS-031337, CID66065, NSC383465, NSC661749, ZINC04046820, 477-90-7 (ANYDROUS), SMR000542844, C09919, D01040, 3,4,4a,10b-Tetrahydro-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxypyrano(3,2-c)(2)benzopyran-6(H)-one, 3,4,8,10-Tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one, 4-Methoxy-2-(tetrahydro-3,4,5-trihydroxy-6-(hydroxymethyl)pyran-2-yl)alpha-resorcylic acid gamma lactone, 5956-63-8, Pyrano[3,2-c][2]benzopyran-6(2H)-one, 3,4,4a,10b-tetrahydro-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-, (2R,3S,4S,4aR,10bS)-

Molecular Formula: C14H16O9Molecular Weight: 328.271440 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: YWJXCIXBAKGUKZ-HJJNZUOJSA-N

• Bisdemethoxycurcumin
IUPAC Name: (1E,6E)-1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione | CAS Registry Number: 33171-05-0
Synonyms: Curcumin III, Didemethoxycurcumin, bisdemethoxy-curcumin, Bis-demethoxycurcumin, BHCMT, Bis(4-hydroxycinnamoyl)methane, Bis(p-hydroxycinnamoyl)methane, CHEBI:269845, NSC687839, AIDS110024, AIDS-110024, CID5315472, B3347, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, C034786, C475935, 1,7-Bis(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione, BRD-K37445107-001-01-9, (1E,6E)-1,7-Bis-(4-hydroxy-phenyl)-hepta-1,6-diene-3,5-dione, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, (1E,6E)-

Molecular Formula: C19H16O4Molecular Weight: 308.327940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PREBVFJICNPEKM-YDWXAUTNSA-N

• Chelerythrine Chloride
IUPAC Name: 1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium | CAS Registry Number: 34316-15-9
Synonyms: chelerythrine, Toddalin, Toddaline, Chelerythrine chloride, Helleritrine hydroxide, Chelerythrine hydroxide, nchembio873-comp36, Chelerythrinium hydroxide, Chelerythrine aurichloride, Lopac-C-2932, Benzophenanthridine alkaloid, Lopac0_000241, BSPBio_001558, 478-03-5 (hydroxide), MEGxp0_001953, 3895-92-9 (chloride), C21H18NO4, EINECS 251-930-0, CID2703, CHEBI:111199

Molecular Formula: C21H18NO4+Molecular Weight: 348.371920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LLEJIEBFSOEYIV-UHFFFAOYSA-N

• Chlorogenic Acid
IUPAC Name: (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid | CAS Registry Number: 327-97-9
Synonyms: Chlorogenate, CHLOROGENIC ACID, Hlorogenic acid, Heriguard, 3-Caffeoylquinic acid, 3-O-Caffeoylquinic acid, Prestwick_112, Caffeoyl quinic acid, Chlorogenic acid hemihydrate, CAS:, Chlorogenic acid (8CI), Prestwick2_000427, Prestwick3_000427, Spectrum5_000733, CCRIS 1400, BSPBio_000414, BSPBio_003353, SPECTRUM210800, MLS002153805, C3878_SIGMA

Molecular Formula: C16H18O9Molecular Weight: 354.308720 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: CWVRJTMFETXNAD-JUHZACGLSA-N

• Cistanoside A
IUPAC Name: [(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-2-[[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 93236-42-1
Synonyms: CID6450499, CID 6450499, beta-D-Glucopyranoside, 2-(4-hydroxy-3-methoxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-, Glucopyranoside, 2-(4-hydroxy-3-methoxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C36H48O20Molecular Weight: 800.754320 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 20

InChIKey: LOGNFAUMIGACHZ-SCWCVTEDSA-N

• Cistanoside B
IUPAC Name: [5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | CAS Registry Number: 93236-41-0

Molecular Formula: C37H50O20Molecular Weight: 814.787 [g/mol]
H-Bond Donor: 10H-Bond Acceptor: 20

InChIKey: XSSFBGUVLPAGRS-RMKNXTFCSA-N

• CISTANOSIDE C
IUPAC Name: [(2S,3S,4R,5R,6R)-2-acetyl-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 94492-22-5
Synonyms: Cistanoside C, BRN 4898592, CID6450503, Glucopyranoside, 2-(3-methoxy-4-hydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L- mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C31H38O15Molecular Weight: 650.624420 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 15

InChIKey: ODZDJYRJONQBSE-PMOLUXFNSA-N

• Cnidium Monnier
IUPAC Name: 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one | CAS Registry Number: 484-12-8
Synonyms: Osthole, Osthol, Ostole, Ostol, Spectrum_001542, SpecPlus_000946, Spectrum2_000723, Spectrum3_001645, Spectrum4_001687, Spectrum5_000334, 7-Methoxy-8-isopentenylcoumarin, 8-(3-Methyl-2-butenyl)herniarin, Oprea1_642606, Oprea1_873803, BSPBio_003369, KBioGR_001954, KBioSS_002022, MLS000574904, MLS001048988, DivK1c_007042

Molecular Formula: C15H16O3Molecular Weight: 244.285740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MBRLOUHOWLUMFF-UHFFFAOYSA-N

• Costunolide
IUPAC Name: (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one | CAS Registry Number: 553-21-9
Synonyms: STOCK1N-49769, AIDS059915, AIDS-059915, NSC106404, CID5281437, C09382, Cyclodeca[b]furan-2(3H)-one, 3a,4,5,8,9,11a-hexahydro-6,10-dimethyl-3-methylene-, (3aS,6E,10E,11aR)-

Molecular Formula: C15H20O2Molecular Weight: 232.318100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HRYLQFBHBWLLLL-AHNJNIBGSA-N

• Daidzein
IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 486-66-8
Synonyms: daidzein, Daidzeol, Diadzein, Isoaurostatin, 4',7-Dihydroxyisoflavone, 7,4'-Dihydroxyisoflavone, Daidzein (6CI), nchembio.76-comp16, Spectrum_000255, Tocris-1417, BiomolKI_000060, Spectrum2_000053, Spectrum3_000191, Spectrum4_001964, Spectrum5_000857, Lopac-D-7802, BiomolKI2_000066, UPCMLD-DP052, CCRIS 7600, Lopac0_000412

Molecular Formula: C15H10O4Molecular Weight: 254.237500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ZQSIJRDFPHDXIC-UHFFFAOYSA-N

• Daidzin
IUPAC Name: 3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | CAS Registry Number: 552-66-9
Synonyms: Daidzoside, Daidzein 7-glucoside, Daidzein-7-glucoside, Daidzein 7-O-glucoside, Ambap7584, 4',7-Dihydroxyisoflavone, daidzein 7-O-beta-D-glucoside, nchembio.2007.28-comp34, MEGxp0_000530, 7-O-B-D-GLUCOPYRANOSIDE, 30408_FLUKA, ACon1_002092, CHEBI:42202, BRN 0059741, Daidzein-7-O-beta-D-glucopyranoside, CID107971, NCGC00163532-01, NCGC00179839-01, LS-39679, C10216

Molecular Formula: C21H20O9Molecular Weight: 416.378100 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: KYQZWONCHDNPDP-QNDFHXLGSA-N

• Demethoxycurcumin
IUPAC Name: (1E,6E)-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione | CAS Registry Number: 22608-11-3
Synonyms: curcumin II, monodemethoxycurcumin, demethoxy-curcumin, BHCFM, 4-Hydroxycinnamoyl(feroyl)methane, CHEBI:270026, NSC687841, AIDS110025, Feruloyl-P-hydroxycinnnamoylmethane, AIDS-110025, CID5469424, C050229, 24939-17-1, (1E,6E)-1-(4-Hydroxy-3-methoxy-phenyl)-7-(4-hydroxy-phenyl)-hepta-1,6-diene-3,5-dione, 1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, 1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)- (VAN), 1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (1E,6E)-, 1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione, 33171-16-3

Molecular Formula: C20H18O5Molecular Weight: 338.353920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: HJTVQHVGMGKONQ-LUZURFALSA-N

• Diacerein
IUPAC Name: 4,5-diacetyloxy-9,10-dioxoanthracene-2-carboxylic acid | CAS Registry Number: 13739-02-1
Synonyms: Diacetylrhein, Diacerhein, Artrodar, Fisiodar, Zondar, Diacerein [INN], Rhein, diacetate, 4,5-Diacetylrhein, Diacereine [French], Diacereinum [Latin], Diacerein (INN), Diacereina [Spanish], Zondar (TN), Spectrum_001876, SpecPlus_000643, Spectrum2_000823, Spectrum3_000937, Spectrum4_001036, Spectrum5_001819, Rhein, diacetate (6CI)

Molecular Formula: C19H12O8Molecular Weight: 368.293780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: TYNLGDBUJLVSMA-UHFFFAOYSA-N

• dihoside B
IUPAC Name: [6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] (Z)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 104777-69-7

Molecular Formula: C35H46O20Molecular Weight: 786.733 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 20

InChIKey: CBVKMAVNTVJDHT-DAXSKMNVSA-N

• Echinacoside
IUPAC Name: [(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 82854-37-3
Synonyms: MEGxp0_001773, CID5281771, NCGC00091915-01, LS-71510, C10450, Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), beta-D-, 2-(3,4-dihydroxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1-3)-[beta-D-glucopyranosyl-(1-6)]-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

Molecular Formula: C35H46O20Molecular Weight: 786.727740 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 20

InChIKey: FSBUXLDOLNLABB-ISAKITKMSA-N

• EPICATECHIN
IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-4,5,7-triol | CAS Registry Number: 13392-26-2
Synonyms: Luteoforol, EINECS 236-471-6, CID114505, CPD-11941, LMPK12020170, 2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol, 2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, 24897-98-1

Molecular Formula: C15H14O6Molecular Weight: 290.268060 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 6

InChIKey: FSYDWKPCKNCRDI-UHFFFAOYSA-N

• Epimedium Extract
IUPAC Name: 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one | CAS Registry Number: 489-32-7
Synonyms: Icariin, Spectrum2_001695, Spectrum3_001130, Spectrum4_001975, Spectrum5_000933, BSPBio_002599, KBioGR_002475, MLS000759413, MLS001424083, SPECTRUM1505257, SPBio_001650, KBio3_002099, BB_NC-0999, Anhydroicaritin-3-O-alpha-rhamnoside, ZINC03960893, CID5318997, SDCCGMLS-0066754.P001, NCGC00178583-01, CPD000466309, SAM001246560

Molecular Formula: C33H40O15Molecular Weight: 676.661700 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 15

InChIKey: TZJALUIVHRYQQB-XLRXWWTNSA-N

• Forsythiaside
IUPAC Name: [(2R,3S,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-4,5-dihydroxy-2-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 79916-77-1
Synonyms: Forsythoside A, CID6439542, beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-

Molecular Formula: C29H36O15Molecular Weight: 624.587140 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 15

InChIKey: DCCFIJRHQPECRS-FRSGXZDMSA-N

• Forsythoside B
IUPAC Name: [(2R,3R,4R,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 81525-13-5
Synonyms: MEGxp0_000314, ACon1_000521, MolPort-001-740-491, NCGC00169000-01, AT-36636, NP-000825, Y0083

Molecular Formula: C34H44O19Molecular Weight: 756.701760 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 19

InChIKey: JMBINOWGIHWPJI-UNSOMVRXSA-N

• Gabapentin
IUPAC Name: 2-[1-(aminomethyl)cyclohexyl]acetic acid | CAS Registry Number: 60142-96-3
Synonyms: gabapentin, Neurontin, Gabapetin, Gabapentine, Aclonium, Gabapentin GR, Gabapen, Novo-Gabapentin, Apo-Gabapentin, Gabapentin Hexal, Gabapentin Stada, PMS-Gabapentin, Gabapentino [Spanish], Neurontin (TN), Prestwick_151, Gabapentin-ratiopharm, Gabapentine [INN-French], Gabapentinum [INN-Latin], Gabapentino [INN-Spanish], gabapentin (Neurontin)

Molecular Formula: C9H17NO2Molecular Weight: 171.236780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N

• Gabapentin hydrochloride
IUPAC Name: 2-[1-(aminomethyl)cyclohexyl]acetic acid hydrochloride | CAS Registry Number: 60142-95-2
Synonyms: EINECS 262-075-8, 1-(Aminomethyl)cyclohexaneacetic acid hydrochloride

Molecular Formula: C9H18ClNO2Molecular Weight: 207.697720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: XBUDZAQEMFGLEU-UHFFFAOYSA-N

• Gemfibrozil
IUPAC Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid | CAS Registry Number: 25812-30-0
Synonyms: gemfibrozil, Lopid, Lipur, Decrelip, Trialmin, Bolutol, Lipazil, Litarek, Ausgem, Pilder, Jezil, Apo-Gemfibrozil, Gemfibromax, Gemfibrosil, Renabrazin, Cholespid, Fibratol, Fibrocit, Gemfibril, Gemlipid

Molecular Formula: C15H22O3Molecular Weight: 250.333380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HEMJJKBWTPKOJG-UHFFFAOYSA-N

• Geniposide
IUPAC Name: methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate | CAS Registry Number: 24512-63-8
Synonyms: CID107848, ZINC03882101, C09781, 27745-20-6, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, methyl ester, (1S,4aS,7aS)-, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, methyl ester, (1S-(1alpha,4aalpha,7aalpha))-

Molecular Formula: C17H24O10Molecular Weight: 388.366460 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: IBFYXTRXDNAPMM-BVTMAQQCSA-N

• Geniposidic Acid
IUPAC Name: (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid | CAS Registry Number: 27741-01-1
Synonyms: Geniposidic acid, CID443354, C11673, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S,4aS,7aS)-, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S-(1alpha,4aalpha,7aalpha))-

Molecular Formula: C16H22O10Molecular Weight: 374.339880 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: ZJDOESGVOWAULF-OGJQONSISA-N

• Ginsenoside Rb2
IUPAC Name: 2-[2-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol | CAS Registry Number: 11021-13-9
Synonyms: Ginsenoside C, CID432450, NSC308878

Molecular Formula: C53H90O22Molecular Weight: 1079.268500 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 22

InChIKey: NODILNFGTFIURN-UHFFFAOYSA-N

• Ginsenoside Rb3
IUPAC Name: (2S,3R,4R,5S,6R)-2-[(E,2R)-2-[(10R,12S,14R)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-12-hydroxy-4,4,10,14-tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-6-methyloct-5-en-2-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol | CAS Registry Number: 68406-26-8
Synonyms: LS-71529, alpha-D-Glucopyranoside, (3-beta,12-beta)-3-((2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-12-hydroxydammar-24-en-20-yl 6-O-beta-D-xylopyranosyl-

Molecular Formula: C53H90O22Molecular Weight: 1079.268500 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 22

InChIKey: SNPYJWZTTUVUIS-SPVOOGFZSA-N

• Ginsenoside Rc
IUPAC Name: 2-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[2-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxyoxane-3,4,5-triol | CAS Registry Number: 11021-14-0
Synonyms: Panaxoside RC, G0902_SIGMA, EINECS 234-253-5, NSC 310104, BRN 1677618, CID100018, NSC310104, SMP2_000126, LS-71253, Ginsenoside-Rc from Panax quinquefolium (American ginseng) root, 20-((6-O-alpha-L-Arabinofuranosyl-beta-D-glucopyranosyl)oxy)-12beta-hydroxydammar-24-en-3beta-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

Molecular Formula: C53H90O22Molecular Weight: 1079.268500 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 22

InChIKey: JDCPEKQWFDWQLI-UHFFFAOYSA-N

• Ginsenoside Rd
IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2S)-2-[(10R,12S,13S,14R,17S)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-12-hydroxy-4,4,10,14-tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-4,6-dimethylhept-5-en-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 52705-93-8
Synonyms: Gypenoside VIII, EINECS 258-118-5, LS-71531, 2-O-beta-D-Glucopyranosyl-(3beta,12beta)-20-(beta-D-glucopyranosyloxy)-12-hydroxydammara-24-en-3-yl-beta-D-glucopyranoside, beta-D-Glucopyranoside, (3-beta,12-beta)-20-(beta-D-glucopyranosyloxy)-12-hydroxydammar-24-en-3-yl 2-O-beta-D-glucopyranosyl-

Molecular Formula: C48H82O18Molecular Weight: 947.153880 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 18

InChIKey: IRBVCFDYIGGFFY-ADSMOORZSA-N

• Ginsenoside Re
IUPAC Name: (2S,3R,5S,6R)-2-[(2S)-2-[(3S,5R,6S,8R,10R,12R,13S,14R,17S)-6-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 52286-59-6
Synonyms: Panaxoside RE, Ginsenoside B2, Chikusetsusaponin IVc, EINECS 257-814-6, AIDS058058, NSC 308877, AIDS-058058, CID73149, EINCES 257-814-6, NSC308877, LS-71254, 2-O-(6-Deoxy-alpha-L-mannopyranosyl)-(3beta,6alpha,12beta)-20-(beta-D-glucopyranosyloxy)-3,12-dihydroxydammar-24-en-6-yl-beta-D-glucopyranoside, .beta.-D-Glucopyranoside, (3.beta.,6.alpha.,12.beta.)-20-(.beta.-D-glucopyranosyloxy)-3,12-dihydroxydammar-24-en-6-yl2-O-(6-deoxy-.alpha.-L-mannopyranosyl)-

Molecular Formula: C48H82O18Molecular Weight: 947.153880 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 18

InChIKey: PWAOOJDMFUQOKB-QVPADXGFSA-N

• Ginsenoside Rg1
IUPAC Name: 2-[[3,12-dihydroxy-4,4,7,10,14-pentamethyl-17-[6-methyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 22427-39-0
Synonyms: Panaxoside A, Sanchinoside C1, Ginsenoside RG1, Ginsenoside g1, Ginsenoside A2, Panaxoside Rg1, Sanchinoside Rg1, ginsenoside-Rg(1), sanchinoside C(1), CID90781, EINECS 244-989-9, C035054, (6)-beta-D-Glucopyranosyl-(20)-beta-D-glucopyranosyl-20S-protopanaxatriol, (3beta,6alpha,12beta)-3,12-Dihydroxydammar-24-ene-6,20-diyl bis-beta-D-Glucopyranoside, (3beta,6alpha,12beta)-3,12-Dihydroxydammar-24-ene-6,20-diylbis(beta-D-glucopyranoside), beta-D-Glucopyranoside, (3beta,6alpha,12beta)-3,12-dihydroxy dammar-24-ene-6,20-diylbis-, beta-D-Glucopyranoside, (3beta,6alpha,12beta)-3,12-dihydroxydammar-24-ene-6,20-diyl bis-, 11054-31-2, 50647-03-5, 75139-45-6

Molecular Formula: C42H72O14Molecular Weight: 801.012680 [g/mol]
H-Bond Donor: 10H-Bond Acceptor: 14

InChIKey: IMRDPGPCESGXDB-UHFFFAOYSA-N

• Glycitein
IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)-6-methoxychromen-4-one | CAS Registry Number: 40957-83-3
Synonyms: CPD-7027, 7,4'-Dihydroxy-6-methoxyisoflavone, CID5317750, LS-185206, ST5331727, C14536, C086566, 7-Hydroxy-3-(4-hydroxyphenyl)-6-methoxy-4H-1-benzopyran-4-one, 4-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-chromen-7-one, 4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-

Molecular Formula: C16H12O5Molecular Weight: 284.263480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: DXYUAIFZCFRPTH-UHFFFAOYSA-N

• Glycitin
IUPAC Name: 3-(4-hydroxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | CAS Registry Number: 40246-10-4
Synonyms: Glycitein 7-O-glucoside, CID187808, C16195

Molecular Formula: C22H22O10Molecular Weight: 446.404080 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: OZBAVEKZGSOMOJ-MIUGBVLSSA-N

• Gypenoside
IUPAC Name: (2S,3R,4S,5S,6R)-2-[2-[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-3,4,5-triol | CAS Registry Number: 41753-43-9
Synonyms: Gynosaponin C, Ginsenoside rb1, Gypenoside III, Panax saponin E, Sanchinoside E1, Arasaponin E1, Pseudoginsenoside D, GRb 1, EINECS 255-532-8, AIDS058057, NSC 310103, AIDS-058057, CID73148, NSC310103, LS-71528, 2-O-beta-Glucopyranosyl-(3beta,12beta)-20-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-12-hydroxydammar-24-en-3-yl-beta-D-glucopyranoside, beta-D-Glucopyranoside, (3-beta,12-beta)-20-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-12-hydroxydammar-24-en-3-yl 2-O-beta-D-glucopyranosyl-, .beta.-D-Glucopyranoside, (3.beta.,12.beta.)-20-[(6-O-.beta.-D-glucopyranosyl-.beta.-D-glucopyranosyl)oxy]-12-hydroxydammar-24-en-3-yl2-O-.beta.-Dglucopyranosyl-

Molecular Formula: C54H92O23Molecular Weight: 1109.294480 [g/mol]
H-Bond Donor: 15H-Bond Acceptor: 23

InChIKey: GZYPWOGIYAIIPV-NGBMAODDSA-N

• Honokiol
IUPAC Name: 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol | CAS Registry Number: 35354-74-6
Synonyms: nchembio.140-comp3, MLS000759481, MLS001048916, MLS001423980, H4914_SIGMA, 3,5'-Diallyl-4,2'-dihydroxybiphenyl, AIDS002243, BB_NC-1461, 3',5-Diallylbiphenyl-2,4'-diol, NSC 293100, AIDS-002243, C18H18O2, CID72303, NSC293100, ZINC00001536, 5,3'-Diallyl-2,4'-dihydroxybiphenyl, SMP2_000040, NCGC00163567-01, NCGC00163567-02, CPD000387107

Molecular Formula: C18H18O2Molecular Weight: 266.334320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FVYXIJYOAGAUQK-UHFFFAOYSA-N

• Isoacteoside
IUPAC Name: [(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-3,5-dihydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 61303-13-7
Synonyms: CID6438553, beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-, 6-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-

Molecular Formula: C29H36O15Molecular Weight: 624.587140 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 15

InChIKey: BYCHRKNAQYPJPR-DAZOONRXSA-N

• Isochlorogenic Acid A
IUPAC Name: (3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid | CAS Registry Number: 2450-53-5
Synonyms: Isochlorogenic acid A, 3,5-Dicaffeoylquinic acid, 3,5-DCQA, 3,5-Di-O-caffeoylquinic acid, CHEMBL249447, CHEBI:65751, 89919-62-0, IsochlorogenicacidA, 3,5-Dicaffeoylquinicacid, 3,5-dicaffeoyl quinic acid, AC1O6F94, Rel-3,5-Dicaffeoylquinic Acid, Quinic acid 3,5-di-O-caffeate, SCHEMBL13567304, ACon1_002290, MolPort-001-740-184, MolPort-027-834-925, AKOS015903388, AKOS016007890, NCGC00169984-01

Molecular Formula: C25H24O12Molecular Weight: 516.450860 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 12

InChIKey: KRZBCHWVBQOTNZ-RDJMKVHDSA-N

• Isochlorogenic Acid B
IUPAC Name: (1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid | CAS Registry Number: 14534-61-3
Synonyms: Isochlorogenic acid b, 3,4-Dicaffeoylquinic acid, 2-Acetylpyridine semicarbazone, 4,5-Di-O-caffeoylquinic acid, ACon1_002212, CHEBI:521395, CID5281780, NCGC00179718-01, LS-185309, C10468, Cyclohexanecarboxylic acid, 3,4-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-1,5-dihydroxy-, (1S,3R,4R,5R)-

Molecular Formula: C25H24O12Molecular Weight: 516.450860 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 12

InChIKey: UFCLZKMFXSILNL-PSEXTPKNSA-N

• Isochlorogenic acid C
IUPAC Name: (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid | CAS Registry Number: 57378-72-0
Synonyms: 4,5-Dicaffeoylquinic acid, 4,5-Di-O-caffeoylquinic acid, CHEMBL177126, NSC-649410, 4,5-dicaffeoyl quinic acid, 3,4-Di-O-Caffeoylquinic acid, IsochlorogenicacidC, (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxy-cyclohexanecarboxylic acid, Isochlorogenic acid I, UNII-E57A0DKE0B, E57A0DKE0B, 3,4-di-O-caffeoylquinicacid, Isochlorogenic acid C(4,5), 3,4-DCQA, 4,5-DCQA, AC1O6F93, SCHEMBL15396049, ACon1_000313, MolPort-001-740-223, HY-N0058

Molecular Formula: C25H24O12Molecular Weight: 516.455 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 12

InChIKey: UFCLZKMFXSILNL-RVXRWRFUSA-N


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