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Mira Biotechnology Co., Ltd.

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Profile: Mira Biotechnology Co., Ltd. specializes in the manufacture & sales of botanical extracts, herbal extracts, and high purity phytochemicals. In addition, we also provide contract research outsourcing (CRO) service. Our products include ginkgo leaf P.E., lingonberry P.E., grape seed P.E., cranberry P.E., black currant P.E., curcuma P.E., tomato P.E., astragalus mongholicus P.E., andrographis paniculata P.E., and sweetberry P.E.

51 to 100 of 690 Products/Chemicals (Click for related suppliers)  Page: << Previous 50 Results 1 [2] 3 4 5 6 7 8 9 10 11 12 13 14 >> Next 50 Results
• Atractylenolide II
IUPAC Name: (4aS,8aR,9aS)-3,8a-dimethyl-5-methylidene-4a,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-2-one | CAS Registry Number: 73069-14-4
Synonyms: CHEMBL485805, AKOS025119314, X1091, C17886

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

InChIKey: OQYBLUDOOFOBPO-KCQAQPDRSA-N

• Atractylenolide III
IUPAC Name: (4aS,8aR,9aS)-9a-hydroxy-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran-2-one | CAS Registry Number: 73030-71-4
Synonyms: CHEBI:543914, CID155948, Naphtho(2,3-b)furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9a-hydroxy-3,8a-dimethyl-5-methylene-, (4aS,8aR,9aS)-

Molecular Formula: C15H20O3Molecular Weight: 248.317500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FBMORZZOJSDNRQ-GLQYFDAESA-N

• Atractylodin
IUPAC Name: 2-[(1E,7E)-nona-1,7-dien-3,5-diynyl]furan | CAS Registry Number: 55290-63-6
Synonyms: CID5321047, (E,E)-2-(1,7-Nonadiene-3,5-diynyl)furan, Furan, 2-(1,7-nonadiene-3,5-diynyl)-, (E,E)-

Molecular Formula: C13H10OMolecular Weight: 182.217900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GRBKWAXRYIITKG-QFMFQGICSA-N

• Atractyloside A
IUPAC Name: (3S,3aR,5R,8R,8aS)-3,8-dihydroxy-8-(hydroxymethyl)-3-methyl-5-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-3a,4,5,6,7,8a-hexahydro-1H-azulen-2-one | CAS Registry Number: 126054-77-1
Synonyms: HY-N0237, ACN-035222, CS-2923, X1094, C17858

Molecular Formula: C21H36O10Molecular Weight: 448.504540 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 10

InChIKey: QNBLVYVBWDIWDM-BSLJOXIBSA-N

• Aucubin
IUPAC Name: (2S,3R,4S,5S,6R)-2-[[(1S,4aR,5S,7aS)-5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 479-98-1
Synonyms: Ambap2262, MEGxp0_001729, 55561_FLUKA, ACon1_002452, EINECS 207-540-8, AIDS031379, NSC 407293, AIDS-031379, CID91458, LMPR01020107, NSC407293, ZINC04098334, NCGC00169833-01, LS-183147, C09771, 1,4a,5,7a-Tetrahydro-5-hydroxy-7-hydroxymethylcyclopenta(c)pyran-1-yl-beta-D-glucopyranoside, (1S-(1alpha,4aalpha,5alpha,7aalpha))-1,4a,5,7a-Tetrahydro-5-hydroxy-7-(hydroxymethyl)cyclopenta(c)pyran-1-yl-beta-D-glucopyranoside, (2S,3R,4S,5S,6R)-2-((1S,4aR,5R,7aS)-5-Hydroxy-7-hydroxymethyl-1,4a,5,7a-tetrahydro-cyclopenta[c]pyran-1-yloxy)-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol

Molecular Formula: C15H22O9Molecular Weight: 346.329780 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: RJWJHRPNHPHBRN-FKVJWERZSA-N

• Avicularin
IUPAC Name: 3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one | CAS Registry Number: 572-30-5
Synonyms: LMPK12112167, Quercetin 3-alpha-L-arabinofuranoside, CID5490064, 4H-1-Benzopyran-4-one, 3-(alpha-L-arabinofuranosyloxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-

Molecular Formula: C20H18O11Molecular Weight: 434.350320 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 11

InChIKey: BDCDNTVZSILEOY-UXYNSRGZSA-N

• Baccatin III
Synonyms: Baccatin- III, B8154_SIGMA, CHEBI:32898, NSC 330753, ZINC04102268, LS-183707, C11900, 7,11-Methano-5H-cyclodeca(3,4)benz(1,2-b)oxet-5-one, 6,12b-bis(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-4,9,11-trihydroxy-4a,8,13,13-tetramethyl-, (2aR-(2aalpha,4beta,4abeta,6beta,9alpha,11alpha,12alpha,12aalpha,12balpha))-, [2aR-(2aalpha,4beta,4abeta,6beta,9alpha,11alpha,12alpha,12aalpha,12balpha)]-6,12b-bis(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-4,9,11-trihydroxy-4a,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca(3,4)benz(1,2-b)oxet-5-one, 5beta,20-epoxy-1,7beta,13alpha-trihydroxy-9-oxotax-11-ene-2alpha,4alpha,10beta-triyl 4,10-diacetate 2-benzoate

Molecular Formula: C31H38O11Molecular Weight: 586.626820 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 11

InChIKey: OVMSOCFBDVBLFW-VHLOTGQHSA-N

• Baicalein
IUPAC Name: 5,6,7-trihydroxy-2-phenylchromen-4-one | CAS Registry Number: 491-67-8
Synonyms: baicalein, 5,6,7-Trihydroxyflavone, Biacalein, Sho-saiko-to, nchembio.65-comp3, Spectrum_000427, Tocris-1761, SpecPlus_000758, Spectrum2_000466, Spectrum3_001608, Spectrum4_000537, Spectrum5_001418, Oprea1_765614, BSPBio_003215, KBioGR_001173, KBioSS_000907, DivK1c_006854, SPECTRUM1504002, SPBio_000572, NSC661431

Molecular Formula: C15H10O5Molecular Weight: 270.236900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: FXNFHKRTJBSTCS-UHFFFAOYSA-N

• Baicalin
IUPAC Name: (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | CAS Registry Number: 21967-41-9
Synonyms: Baicalein 7-O-glucuronide, Baicalein-7-D-glucuronide, 572667_ALDRICH, CHEBI:2981, STOCK1N-21299, TJN-151, AIDS001402, 7-D-Glucuronic acid-5,6-dihydroxyflavone, AIDS-001402, CID64982, LS-71490, C10025, 5,6,7-Trihydroxyflavone-7-O-.beta.-D-glucopyranosideuronic acid, beta-D-Glucopyranosiduronic acid, 5,6-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl, 5,6-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid, 5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranosiduronic acid, 100647-26-5, 27462-75-5, 31564-28-0

Molecular Formula: C21H18O11Molecular Weight: 446.361020 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: IKIIZLYTISPENI-ZFORQUDYSA-N

• Bakkenolide A
IUPAC Name: (2R,3aR,7S,7aR)-7,7a-dimethyl-4'-methylidenespiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-2'-one | CAS Registry Number: 19906-72-0
Synonyms: Fukinanolid, Bakkenolid A, FUKINANOLIDE, CID442173, NSC 292655, C09350, Spiro(furan-3(2H),2'-(2H)inden)-2-one, decahydro-3'a,4'-dimethyl-4-methylene-, (2'R-(2'alpha,3'aalpha,4'alpha,7'aalpha))- (9CI), Spiro(furan-3(2H),2'-indan)-2-one, 3'a,4,4',5,5',6',7',7'abeta-octahydro-3'abeta,4'beta-dimethyl-4-methylene-, (2'R)- (8CI)

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OVXAYHNZXBOVPV-QMGNLALYSA-N

• Bakuchiol
IUPAC Name: 4-[(1E,3S)-3-ethenyl-3,7-dimethylocta-1,6-dienyl]phenol | CAS Registry Number: 10309-37-2
Synonyms: Backuchiol, Drupanol, (+)-Bakuchiol, C18H24O, CHEBI:529074, AIDS046581, AIDS-046581, NSC671195, ZINC01644304, CID5468522, LS-104607, 4-(3-Ethenyl-3,7-dimethyl-1,6-octadienyl)phenol, (S)-4-(3,7-dimethyl-3-vinylocta-1,6-dienyl)phenol, Phenol, 4-(3-ethenyl-3,7-dimethyl-1,6-octadienyl)-, (S-(E))-, Phenol, 4-[(1E,3S)-3-ethenyl-3,7-dimethyl-1,6-octadienyl]-

Molecular Formula: C18H24OMolecular Weight: 256.382560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LFYJSSARVMHQJB-QIXNEVBVSA-N

• Baohuoside I
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: 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

• Barlerin
IUPAC Name: methyl (1S,4aS,5R,7S,7aS)-7-acetyloxy-5-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate | CAS Registry Number: 57420-46-9
Synonyms: Umbroside, Ac-Shanz-ME, 8-O-Acetyl shanzhiside methyl ester, CHEBI:603452, 8-O-Acetylshanzhiside methyl ester, CID162823, Cyclopenta(c)pyran-4-carboxylic acid, 7-(acetyloxy)-1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5-hydroxy-7-methyl-, methyl ester, (1S-(1alpha,4aalpha,5alpha,7alpha,7aalpha))-, InChI=1/C19H28O12/c1-7(21)31-19(2)4-9(22)11-8(16(26)27-3)6-28-17(12(11)19)30-18-15(25)14(24)13(23)10(5-20)29-18/h6,9-15,17-18,20,22-25H,4-5H2,1-3H3/t9-,10-,11+,12-,13-,14+,15-,17+,18+,19+/m1/s

Molecular Formula: C19H28O12Molecular Weight: 448.418420 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 12

InChIKey: ARFRZOLTIRQFCI-NGQYDJQZSA-N

• Bavachin
IUPAC Name: 7-hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one | CAS Registry Number: 19879-32-4
Synonyms: AC1NT0TY, SureCN601740, AGN-PC-000SXC, CTK8F7925, LMPK12140039, AG-L-64979, FT-0689312, (2S)-7-hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one, 7-hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

Molecular Formula: C20H20O4Molecular Weight: 324.370400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: OAUREGNZECGNQS-UHFFFAOYSA-N

• Benzoylaconine
Synonyms: Picraconitine, Pikraconitin, Benzaconine, Isaconitine, BRN 0073066, LS-109737, 4-21-00-02901 (Beilstein Handbook Reference)

Molecular Formula: C32H45NO10Molecular Weight: 603.700400 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: DHJXZSFKLJCHLH-LPDAJWQZSA-N

• Benzoylhypaconine
Synonyms: Benzoylhypaconitine, N1943

Molecular Formula: C31H43NO9Molecular Weight: 573.674420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 10

InChIKey: MDFCJNFOINXVSU-CULIVVSNSA-N

• Benzoylmesaconine
Synonyms: Mesaconine 14-benzoate, BRN 0072534, 4-21-00-02898 (Beilstein Handbook Reference), Aconitane-3,8,13,14,15-pentol, 4-(methoxymethyl)-20-methyl-1,6,16-trimethoxy-, 14-benzoate, (1-alpha,3-alpha,6-alpha,14-alpha,15-alpha,16-beta)-

Molecular Formula: C31H43NO10Molecular Weight: 589.673820 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: PULWZCUZNRVAHT-CESOWLAWSA-N

• Benzoylpaeoniflorin
Synonyms: CID170087, beta-D-Glucopyranoside, 5b-((benzoyloxy)methyl)tetrahydro-5-hydroxy-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta(cd)pentalen-1a(2H)-yl, 6-benzoate, (1aR-(1aalpha,2beta,3aalpha,5alpha,5aalpha,5balpha))-

Molecular Formula: C30H32O12Molecular Weight: 584.567880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 12

InChIKey: KHRHASRIMPQOPU-PAMKKNMFSA-N

• Berberine chloride
Synonyms: berberine chloride, Benzodioxide, Berberine HCl, Berberinium chloride, Prestwick_91, Berberine hydrochloride, Natural Yellow 18, Natural Yellow- 18, Berberine chloride form, Berberine chloride [JAN], Berberine chloride dihydrate, MLS002153890, B3251_SIGMA, SPECTRUM1500811, 14050_FLUKA, EINECS 211-195-9, NSC163088, NSC 163088, CID12456, NSC646666

Molecular Formula: C20H18ClNO4Molecular Weight: 371.814220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VKJGBAJNNALVAV-UHFFFAOYSA-M

• Bergapten
IUPAC Name: 4-methoxyfuro[3,2-g]chromen-7-one | CAS Registry Number: 484-20-8
Synonyms: 5-Methoxypsoralen, bergaptene, Heraclin, Majudin, Pentaderm, Psoraderm, BERGAPTAN, Isopimpinellin, Bergapten(e), O-Methylbergaptol, 5-Methoxy psoralen, Pentaderm (TN), 5-Methoxyfuranocoumarin, 5-Mop, Spectrum_000794, Spectrum2_000534, Spectrum3_000663, Spectrum4_001478, Spectrum5_000155, 5-Methoxy-6,7-furanocoumarin

Molecular Formula: C12H8O4Molecular Weight: 216.189520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BGEBZHIAGXMEMV-UHFFFAOYSA-N

• 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

• beta-Eudesmol
IUPAC Name: 2-[(2R,4aR,8aS)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-ol | CAS Registry Number: 473-15-4
Synonyms: beta-Selinenol, gamma-Eudesmol, Eudesm-4(14)-en-11-ol, 17790_FLUKA, 17790_SIGMA, C15H26O, CHEBI:244417, MolPort-003-927-230, CID91457, Eudesm-4(14)-en-11-ol (8CI), LS-94778, C09664, 2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, (2R,4aR,8aS)-, 2-Naphthalenemethanol, decahydro-8-methylene-alpha,alpha,4a-trimethyl-, (2R-(2-alpha,4a-alpha,8a-beta)-, (2R,4aR,8aS)-Decahydro-8-methylene-alpha,alpha,4a-trimethyl-2-naphthylmethanol, 2-((2R,4aR,8aS)-4a-Methyl-8-methylene-decahydro-naphthalen-2-yl)-propan-2-ol, rel-2-[(2R,4aR,8aS)-4a-methyl-8-methylenedecahydronaphthalen-2-yl]propan-2-ol, InChI=1/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3/t12-,13+,15-/m1/s

Molecular Formula: C15H26OMolecular Weight: 222.366340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BOPIMTNSYWYZOC-VNHYZAJKSA-N

• Beta-Sitosterol
IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 83-46-5
Synonyms: Sitosterol, BETA-SITOSTEROL, Quebrachol, Angelicin, Cinchol, Cupreol, Rhamnol, Harzol, Triastonal, Sitosterol beta, Sito-Lande, .beta.Sitosterin, .beta.Sitosterol, Steroids, hydroxy, Refined soy sterol, .beta.-Sitosterin, .beta.-Sitosterol, Angelicin (steroid), alpha-Dihydrofucosterol, alpha.Dihydrofucosterol

Molecular Formula: C29H50OMolecular Weight: 414.706700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KZJWDPNRJALLNS-VJSFXXLFSA-N

• Betaine
IUPAC Name: 2-(trimethylazaniumyl)acetate | CAS Registry Number: 107-43-7
Synonyms: betaine, glycine betaine, oxyneurine, lycine, Abromine, Glycylbetaine, Trimethylglycine, Trimethylglycocoll, Jortaine, acidin-pepsin, Glycocoll betaine, alpha-Earleine, Cystadane, Rubrine C, Aminocoat, Greenstim, Betafin, FinnStim, Loramine AMB 13, Betaine solution

Molecular Formula: C5H11NO2Molecular Weight: 117.146340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KWIUHFFTVRNATP-UHFFFAOYSA-N

• Betaine chloride
IUPAC Name: carboxymethyl(trimethyl)azanium chloride | CAS Registry Number: 590-46-5
Synonyms: Betaine hydrochloride, Acidogeno, Acipepsol, Pluchine, Achylin, Acinorm, Acidin, Acidol, Acidol-Pepsin, Aciventral forte, Cystadane, Cystdane, Mixture Name, ACIDINE, Acidol hydrochloride, Cystdane (TN), Lycine hydrochloride, Rubrine C hydrochloride, component of Normacid, BETAINE HYDRATE

Molecular Formula: C5H12ClNO2Molecular Weight: 153.607280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HOPSCVCBEOCPJZ-UHFFFAOYSA-N

• Betulin
IUPAC Name: (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol | CAS Registry Number: 473-98-3
Synonyms: Betulinol, Trochol, Betuline, Betulol, Messagenin, Triterpenoid, Betulinic alcohol, Betulin, 23, Ambap4788, Prestwick3_000990, BSPBio_001059, NSC 4644, B9757_SIGMA, Lup-20(29)-ene-3beta,28-diol, BPBio1_001165, MEGxp0_001726, ACon1_000091, EINECS 207-475-5, Lup-20(30)-ene-3beta,28-diol, NSC4644

Molecular Formula: C30H50O2Molecular Weight: 442.716800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FVWJYYTZTCVBKE-ROUWMTJPSA-N

• Betulinaldehyde
IUPAC Name: 9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde | CAS Registry Number: 13159-28-9
Synonyms: BETULINALDEHYDE, NSC250423, CID317607, FL 155

Molecular Formula: C30H48O2Molecular Weight: 440.700920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FELCJAPFJOPHSD-UHFFFAOYSA-N

• Betulinic acid
IUPAC Name: (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid | CAS Registry Number: 472-15-1
Synonyms: betulinic acid, Mairin, Betulic acid, Prestwick_95, Betulinic Acid, 24, Prestwick0_000417, Prestwick1_000417, Prestwick2_000417, Prestwick3_000417, CCRIS 6748, BSPBio_000374, BSPBio_001587, MLS000728510, SPBio_002313, NSC677578, 855057_ALDRICH, BPBio1_000412, EINECS 207-448-8, AIDS005859, NSC 113090

Molecular Formula: C30H48O3Molecular Weight: 456.700320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QGJZLNKBHJESQX-FZFNOLFKSA-N

• Betulonic acid
IUPAC Name: (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid | CAS Registry Number: 4481-62-3
Synonyms: 3-Deoxy-3-oxo-betulinic acid, CHEBI:171232, AIDS051817, AIDS-051817, CID122844, 3-Oxolup-20(29)-en-28-oic acid, Lup-20(29)-en-28-oic acid, 3-oxo-, (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-1-Isopropenyl-5a,5b,8,8,11a-pentamethyl-9-oxo-eicosahydro-cyclopenta[a]chrysene-3a-carboxylic acid, (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-1-Isopropenyl-5a,5b,8,8,11a-pentamethyl-9-oxo-icosahydro-cyclopenta[a]chrysene-3a-carboxylic acid

Molecular Formula: C30H46O3Molecular Weight: 454.684440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SLJTWDNVZKIDAU-SVAFSPIFSA-N

• Bicuculline
IUPAC Name: (6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one | CAS Registry Number: 485-49-4
Synonyms: bicuculline, Bicculine, d-Bicuculline, Bicucullin, Bicuculline (+), ()-Bicuculline, Prestwick_96, (+)-Bicuculline, Prestwick0_000589, Prestwick1_000589, Prestwick2_000589, Prestwick3_000589, Biomol-NT_000252, Lopac0_000234, BSPBio_000438, MLS002153892, DivK1c_000609, SPBio_002657, BPBio1_000482, BPBio1_000794

Molecular Formula: C20H17NO6Molecular Weight: 367.352080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: IYGYMKDQCDOMRE-ZWKOTPCHSA-N

• Bilirubin
IUPAC Name: 3-[2-[[3-(2-carboxyethyl)-5-[(Z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(Z)-(4-ethenyl-3-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid | CAS Registry Number: 635-65-4
Synonyms: bilirubin, Hematoidin, Hemetoidin, Bilirubin IX-alpha, Bilirubin IXalpha, Principal bile pigment, Spectrum5_000410, BSPBio_002531, B4126_SIGMA, SPECTRUM1500857, STOCK1N-16503, 14370_FLUKA, CHEBI:16990, EINECS 211-239-7, NSC 26685, S00334a, BRN 0074376, HSCI1_000394, AI3-23078, SDCCGMLS-0066651.P001

Molecular Formula: C33H36N4O6Molecular Weight: 584.662140 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: BPYKTIZUTYGOLE-IFADSCNNSA-N

• Bilobalide
Synonyms: Ambap2349, MLS000563448, AIDS029698, AIDS-029698, CID73581, NCGC00142501-01, NCGC00142501-02, SMR000232342, ST057155, LS-183112, 4H,5aH,9H-Furo(2,3-b)furo(3',2':2,3)cyclopenta(1,2-c)furan-2,4,7(3H,8H)-trione, 9-(1,1-dimethylethyl)-10,10a-dihydro-8,9-dihydroxy-, (5aR-(3aS*,5aalpha,8beta,8aS*,9alpha,10aalpha))-, 4H,5aH,9H-Furo[2,3-b]furo[3',2':2,3]cyclopenta[1,2-c]furan-2,4,7(3H,8H)-trione, 9-(1,1-dimethylethyl)-10,10a-dihydro-8,9-dihydroxy-,(3aS,5aR,8R,8aS,9R,10aS)-

Molecular Formula: C15H18O8Molecular Weight: 326.298620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: MOLPUWBMSBJXER-YDGSQGCISA-N

• Bilobetin
IUPAC Name: 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 521-32-4
Synonyms: AC1NST1Z, 4'-Monomethylamentoflavone, Ambap521-32-4, CHEMBL378188, CHEBI:449099, 3''',8-Biflavone, 4',5,5'',7,7''-pentahydroxy-4'''-methoxy-, 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

Molecular Formula: C31H20O10Molecular Weight: 552.484500 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: IWEIJEPIYMAGTH-UHFFFAOYSA-N

• Biochanin A
IUPAC Name: 5,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one | CAS Registry Number: 491-80-5
Synonyms: biochanin A, Biochanin, 4'-Methylgenistein, olmelin, Biochanine A, Biochanin-A, Genistein 4-methyl ether, Biochanin A (BCA), Spectrum_000195, 5,7-Dihydroxy-4'-methoxyisoflavone, Spectrum2_000047, Spectrum3_001098, Spectrum4_001927, Spectrum5_001624, Genistein 4'-methyl ether, biochanin A, 14C-labeled, CCRIS 5449, Oprea1_038096, BSPBio_002776, KBioGR_002274

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

InChIKey: WUADCCWRTIWANL-UHFFFAOYSA-N

• Borneol
IUPAC Name: 1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol | CAS Registry Number: 507-70-0
Synonyms: d-Borneol, Isoborneol, Sumatra camphor, Borneocamphor, endo-2-Bornanol, Borneo camphor, Bornyl alcohol, (+)-Borneol, L-Borneol, Endo-2-camphanol, (-)-Borneol, Endo-2-hydroxycamphane, (1R,2S,4R)-Borneol, BORNEOL, (L), CCRIS 6550, 1,7,7-trimethylnorbornan-2-ol, CHEBI:28093, EINECS 207-352-6, (1R,2S,4R)-(+)-Borneol, (1S,2R,4S)-(-)-Borneol

Molecular Formula: C10H18OMolecular Weight: 154.249320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DTGKSKDOIYIVQL-UHFFFAOYSA-N

• Botanical Extracts
• Buddlejasaponin Iv, Hplc 98%
Synonyms: Buddlejasaponin IV, AC1L4BE9, CHEMBL510087, Y0043, beta-D-Galactopyranoside, (3beta,4alpha,16beta)-13,28-epoxy-16,23-dihydroxyolean-11-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-6-deoxy-

Molecular Formula: C48H78O18Molecular Weight: 943.122120 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 18

InChIKey: IRJDRINEGANBIK-ARKKLDSOSA-N

• Bufalin
IUPAC Name: 5-[(3S,5R,10S,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one | CAS Registry Number: 465-21-4
Synonyms: bufalin, NSC 89595, C24H34O4, CID10061, BRN 5141601, 3,14-Dihydroxy-bufa-20,22-dienolide, LS-45286, 3-beta,14-Dihydroxy-5-beta-bufa-20,22-dienolide, 5-beta-BUFA-20,22-DIENOLIDE, 3-beta,14-DIHYDROXY-, 5beta-Bufa-20,22-dienolide, 3beta,14-dihydroxy-, 5beta-Bufa-20,22-dienolide, 3beta,14-dihydroxy- (8CI), Bufa-20,22-dienolide, 3,14-dihydroxy-, (3beta,5beta)-, Bufa-20,22-dienolide, 3,14-dihydroxy-, (3-beta,5-beta)-, Bufa-20,22-dienolide, 3,14-dihydroxy-, (3-beta,5-beta)- (9CI), Bufa-20,22-dienolide, 3,14-dihydroxy-, (3beta,5beta)- (9CI)

Molecular Formula: C24H34O4Molecular Weight: 386.524360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QEEBRPGZBVVINN-ZXRSHIDQSA-N

• Bullatine A

Molecular Formula: C22H33NO2Molecular Weight: 343.502920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: OVXLNQAYPUEDSI-LVIQKLEBSA-N

• Bulleyaconitine A
Synonyms: CID159311, LS-91078, Methanone, ((1-alpha,6-alpha,14-alpha,16-beta)-8-(acetyloxy)-20-ethyl-13-hydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl)(4-methoxyphenyl)-

Molecular Formula: C35H49NO9Molecular Weight: 627.764860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: YRECILNLFWZVRM-UHFFFAOYSA-N

• Butylphthalide
Synonyms: CID5220836, DAP1_013306

Molecular Formula: C41H34ClFIN3O7Molecular Weight: 862.080433 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: GXHDSDRJQBDHBA-UHFFFAOYSA-N

• Caffeic Acid
IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 331-39-5
Synonyms: caffeic acid, trans-Caffeate, 3,4-Dihydroxycinnamic acid, trans-caffeic acid, Caffeic acid polymer, Cinnamic acid, 3,4-dihydroxy-, 3,4-Dihydroxy-trans-cinnamate, CCRIS 847, 3,4-Dihydroxybenzeneacrylic acid, 3,4-Dihydroxy-cinnamic acid, HSDB 7088, MLS000069738, MLS001076493, C0625_SIGMA, SPECTRUM1503987, ARONIS023304, C9H8O4, NSC57197, 3-(3,4-Dihydroxyphenyl)propenoic acid, 60018_FLUKA

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QAIPRVGONGVQAS-DUXPYHPUSA-N

• Caffeine
IUPAC Name: 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 58-08-2
Synonyms: caffeine, Cafeina, Guaranine, Caffein, Koffein, Mateina, Methyltheobromine, Alert-pep, Thein, Cafipel, Theine, Caffedrine, Coffeine, Dexitac, Refresh'n, Stim, Methyltheobromide, Cafamil, Cafecon, Caffine

Molecular Formula: C8H10N4O2Molecular Weight: 194.190600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RYYVLZVUVIJVGH-UHFFFAOYSA-N

• Calceolarioside B
IUPAC Name: [(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 105471-98-5
Synonyms: CHEBI:68345, AC1NRV68, CHEMBL518414, MEGxp0_000508, ACon1_000407, CHEBI:603400, MolPort-001-740-673, DNC008874, ZINC14512219, AKOS016010662, NCGC00169106-01, AK120356, NP-001366, Y0045, [(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, 2-(3,4-Dihydroxyphenyl)ethyl 6-O-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]-beta-D-glucopyranoside, beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 6-O-[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-

Molecular Formula: C23H26O11Molecular Weight: 478.445940 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 11

InChIKey: LFKQVVDFNHDYNK-FOXCETOMSA-N

• Calycosin
IUPAC Name: 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one | CAS Registry Number: 20575-57-9
Synonyms: 3'-hydroxyformononetin, Ambap3821, MLS000876988, MEGxp0_001325, ACon1_000650, CHEBI:17793, CPD-9539, 3',7-dihydroxy-4'-methoxyisoflavone, 7,3'-dihydroxy-4'-methoxyisoflavone, CID5280448, NCGC00169494-01, SMR000440659, C01562, 20575-57-9 NIL |hartmut| 3316550128 NIL NIL, 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one

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

InChIKey: ZZAJQOPSWWVMBI-UHFFFAOYSA-N

• Calycosin-7-O-β-D-glucoside
IUPAC Name: 3-(3-hydroxy-4-methoxyphenyl)-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | CAS Registry Number: 20633-67-4
Synonyms: Calycosin-7-glucoside, N1413

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

InChIKey: WACBUPFEGWUGPB-JQQDRUSQSA-N

• Cantharidin
Synonyms: cantharidin, Cantharone, Kantaridin, Cantharides, Cantharides camphor, Blister beetles, Spanish fly, CANTHARIDINE, Kantharidin [German], Caswell No. 157, Cantharis vesicatoria, Ambap5104, Prestwick3_000885, CCRIS 635, NCIMech_000301, BSPBio_000670, HSDB 2181, NSC61805, BPBio1_000738, EINECS 200-263-3

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: DHZBEENLJMYSHQ-XCVPVQRUSA-N

• Carnosic acid
IUPAC Name: (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid | CAS Registry Number: 3650-09-7
Synonyms: Salvin, RoseOx, UPCMLD-DP056, UPCMLD-DP056:001, NSC694080, C20H28O4, CID65126, SMP2_000204, NCGC00161623-01, NCI60_033653, LS-174601, 4a(2H)-Phenanthrenecarboxylic acid, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-trans)-, Podocarpa-8,11,13-trien-17-oic acid, 11,12-dihydroxy-13-isopropyl-

Molecular Formula: C20H28O4Molecular Weight: 332.433920 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QRYRORQUOLYVBU-VBKZILBWSA-N

• Carnosol
Synonyms: carnosol, CHEBI:468005, CID442009, C09069

Molecular Formula: C20H26O4Molecular Weight: 330.418040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XUSYGBPHQBWGAD-PJSUUKDQSA-N

• Casticin
IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxychromen-4-one | CAS Registry Number: 479-91-4
Synonyms: Vitexicarpin, LMPK12113010, CID5315263, Quercetagetin 3,6,7,4'-tetramethyl ether, 3',5-Dihydroxy-3,4',6,7-tetramethoxyflavone, 4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-

Molecular Formula: C19H18O8Molecular Weight: 374.341420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: PJQLSMYMOKWUJG-UHFFFAOYSA-N


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