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Topharman Shanghai Co Ltd

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Web: http://www.topharman.com
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Address: Building 1, No.388 Jialilue Road, Zhangjiang Hitech Park, Pudong, Shanghai 201203, China
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Profile: Topharman Shanghai Co Ltd manufactures active pharmaceutical intermediates. Our product includes bumetanide, adapalene, ambazone, aminocarb, antazolin, bicifadine and delavirdine. We also provide doxazosin, exalamide, fenoxazoline, fluoxetine, tegaserod, zaleplon and zoledronic acid.

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• PYRIDIN-3-YLAMINE,N-(1-METHYLETHYL)-2-(PIPERAZIN-1-YL)-,2HCL MONOHYDRATE
IUPAC Name: 2-piperazin-1-yl-N-propan-2-ylpyridin-3-amine;hydrate;dihydrochloride | CAS Registry Number: 147539-21-7
Synonyms: 3-PYRIDYLAMINE, N-(1-METHYLETHYL)-2-(1-PIPERAZINYL)-,DIHYDROCHLORIDE MONOHYDRATE, AKOS015965775, 3-Pyridylamine, N-(1-methylethyl)-2-(1-piperazinyl)-,

Molecular Formula: C12H24Cl2N4OMolecular Weight: 311.251160 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 5

InChIKey: JXYHOZKGJUVECC-UHFFFAOYSA-N

• PYRIDINE,2-BROMO-4-(PIPERIDIN-1-YLMETHYL)-
IUPAC Name: 2-bromo-4-(piperidin-1-ylmethyl)pyridine | CAS Registry Number: 88046-02-0
Synonyms: 2-bromo-4-(1-piperidinomethyl)pyridine, pyridine, 2-bromo-4-(1-piperidinylmethyl)-, 2-Bromo-4-(1-piperidinylmethyl)pyridine, zlchem 945, AGN-PC-00NFTD, CTK5I9096, ZLD0411, MolPort-005-938-610, 2-bromo-4-(piperidinomethyl)pyridine, AKOS015965221, AG-C-21418, AG-H-54988, AK112565, 2-bromo-4-(1-piperidinylmethyl) pyridine, 2-Bromo-4-(piperidin-1-ylmethyl)pyridine, KB-168885, KB-228752, 2-bromo-4-((piperidin-1-yl)methyl)pyridine, 2-Bromo-4-[(piperidin-1-yl)methyl]pyridine;

Molecular Formula: C11H15BrN2Molecular Weight: 255.154200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZTUBSWOWTOUXJJ-UHFFFAOYSA-N

• PYRIMIDIN-2-AMINE,4,6-DICHLORO-5-(1-METHYLETHYL)-
IUPAC Name: 4,6-dichloro-5-propan-2-ylpyrimidin-2-amine | CAS Registry Number: 500161-46-6
Synonyms: 2-Amino-4,6-dichloro-5-isopropylpyrimidine, OR15928, 4,6-dichloro-5-isopropylpyrimidin-2-amine, PYR075, SCHEMBL12495771, CTK6A4491, ZX-AT015006, MFCD09998387, ZINC15021884, AKOS025401641, AC-2393, FCH1397463, HP21524, AK390502, HE345750, 2-Pyrimidinamine, 4,6-dichloro-5-(1-methylethyl)-

Molecular Formula: C7H9Cl2N3Molecular Weight: 206.070 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZIGZBWFRRSIFAH-UHFFFAOYSA-N

• Pyrithioxin
IUPAC Name: 5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyldisulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol | CAS Registry Number: 1098-97-1
Synonyms: Encefabol, Bonifen, Epocan, Bonol, Biocefalin, Pyritioxine, Pyrithioxine, Piritinol, PYRITINOL, Pyridoxine disulfide, Dipyridoxolyldisulfide, Vitamin B6 disulfide, Piritinolo [DCIT], Pyridoxine-5-disulfide, Pyritinol (INN), Pyrithioxine (JAN), Piritinol [INN-Spanish], Pyritinolum [INN-Latin], Pyritinol [BAN:DCF:INN], Pyritinol [INN:BAN:DCF]

Molecular Formula: C16H20N2O4S2Molecular Weight: 368.471000 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: SIXLXDIJGIWWFU-UHFFFAOYSA-N

• PYRROLIDINYL)-,(2?3A,5A,16?17?-
IUPAC Name: (2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-dipyrrolidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 144209-33-6
Synonyms: DB-050281, (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-pyrrolidin-1-yl-androstane-3,17-diol

Molecular Formula: C27H46N2O2Molecular Weight: 430.666340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BYFWHQOQVWTTLG-QJRNWJQSSA-N

• Quercetin Dihydrate
IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one dihydrate | CAS Registry Number: 6151-25-3
Synonyms: Quercetin dihydrate, Quercetine dihydrate, Prestwick_541, Quercetin, Dihydrate, QUERCITRIN DIHYDRATE, CCRIS 3304, CID5284452, LS-1471, NCGC00017056-01, CAS-6151-25-3, ST5309238, Flavone, 3,3',4',5,7-pentahydroxy-, dihydrate, 3,3′,4′,5,7-Pentahydroxyflavone, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate, QUERCETIN DIHYDRATE (SEE ALSOQUERCETIN (117-39-5))

Molecular Formula: C15H14O9Molecular Weight: 338.266260 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 9

InChIKey: GMGIWEZSKCNYSW-UHFFFAOYSA-N

• Quercitrin
IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one | CAS Registry Number: 522-12-3
Synonyms: quercitrin, Thujin, Quercetin 3-rhamnoside, Quercetin-3-rhamnoside, MLS002472998, NSC9221, MEGxp0_000185, ACon1_000189, CHEBI:17558, AIDS001408, AIDS-001408, Quercetin 3-O-alpha-rhamnopyranoside, ZINC04175638, 6151-25-3 (DIHYDRATE), AKJ-244-27, CID5280459, SMP1_000253, luteolin 6-deoxy-alpha-L-mannopyranoside, SMR001397103, C.I. 75720

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

InChIKey: OXGUCUVFOIWWQJ-HQBVPOQASA-N

• Quetiapine sulfoxide
IUPAC Name: 2-[2-[4-(11-oxobenzo[b][1,4]benzothiazepin-6-yl)piperazin-1-yl]ethoxy]ethanol | CAS Registry Number: 329216-63-9
Synonyms: Quetiapine Sulfoxide, Ethanol, 2-[2-[4-(5-oxidodibenzo[b,f][1,4]thiazepin-11-yl)-1-piperazinyl]ethoxy]-, Quetiapine S-Oxide, CHEMBL1199, ETH011, CTK8F1295, CTK8I2247, AKOS015965462, SULFOXIDE METABOLITE (INACTIVE), AC-20385, FT-0674261, 2-[2-[4-(5-Oxidodibenzo[b,f][1,4]thiazepin-11-yl)-1-piperazinyl]ethoxy]ethanol

Molecular Formula: C21H25N3O3SMolecular Weight: 399.506500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: FXJNLPUSSHEDON-UHFFFAOYSA-N

• QUINAZOLINE,2,4-DICHLORO-6-NITRO
IUPAC Name: 2,4-dichloro-6-nitroquinazoline | CAS Registry Number: 74173-77-6
Synonyms: 2,4-Dichloro-6-Nitroquinazoline, Quinazoline, 2,4-dichloro-6-nitro, QUI038, MolPort-005-938-615, ZINC21992986, Quinazoline, 2,4-dichloro-6-nitro-, AKOS015965269, AB45697, 2,4-bis(chloranyl)-6-nitro-quinazoline, 2,4-DICHLORO-6-NITRO QUINAZOLINE, AC-20407, AK114391, KB-225600, A19120, A838049

Molecular Formula: C8H3Cl2N3O2Molecular Weight: 244.034320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HGHPXBLOAQXDCO-UHFFFAOYSA-N

• QUINOLINYL)VINYL]PHENYL]-2-ALLYL]-,-DIMETHYL-
IUPAC Name: 2-[2-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]prop-2-enyl]phenyl]propan-2-ol | CAS Registry Number: 168214-68-4
Synonyms: SureCN1204661, BEN107, Benzenemethanol, 2-[3-[3-[2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-2-propen-1-yl]-|A,|A-dimethyl-

Molecular Formula: C29H26ClNOMolecular Weight: 439.975840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DLLVZUPJFUZKDX-VXFWDVHGSA-N

• Rhamnosylvitexin
IUPAC Name: 8-[(2S,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]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 64820-99-1
Synonyms: 2-O-Rhamnosylvitexin, Vitexin 2''-rhamnoside, Vitexin-2-O-rhamnoside, Vitexin-2''-rhamnoside, 2''-O-Rhamnosylvitexin, MEGxp0_001018, 55608_FLUKA, ACon1_001257, Vitexin 2''-O-beta-L-rhamnoside, Apigenin-8-C-glucoside-2'-rhamnoside, CID5282151, NCGC00169526-01, C12628

Molecular Formula: C27H30O14Molecular Weight: 578.518700 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 14

InChIKey: LYGPBZVKGHHTIE-HUBYJIGHSA-N

• Rhein
IUPAC Name: 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid | CAS Registry Number: 478-43-3
Synonyms: Rhubarb Yellow, Monorhein, Cassic acid, Rheic acid, dipropionyl rhein, Chrysazin-3-carboxylic acid, CCRIS 5129, MLS000069639, R7269_SIGMA, 275611_ALDRICH, MEGxp0_001866, ACon1_000217, EINECS 207-521-4, C15H8O6, 4,5-DiOH-anthraquinone-2-COOH, NSC 38629, AIDS001379, 4,5-Dihydroxyanthraquinone-2-carboxylic acid, AIDS-001379, NSC38629

Molecular Formula: C15H8O6Molecular Weight: 284.220420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: FCDLCPWAQCPTKC-UHFFFAOYSA-N

• Rhynchophylline
IUPAC Name: methyl (E)-2-[(3R,6'R,7'S,8'aS)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate | CAS Registry Number: 76-66-4
Synonyms: Rhyncophylline, Ambap947, CID5281408, TL8003244, C09236

Molecular Formula: C22H28N2O4Molecular Weight: 384.468720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DAXYUDFNWXHGBE-KAXDATADSA-N

• Saikosaponin A
Synonyms: AIDS211406, AIDS-211406, C08975, beta-D-Galactopyranoside, (3beta,4alpha,16beta)-13,28-epoxy-16,23-dihydroxyolean-11-en-3-yl-6-deoxy-3-O-beta-D-glucopyranosyl-

Molecular Formula: C42H68O13Molecular Weight: 780.981520 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 13

InChIKey: KYWSCMDFVARMPN-MSSMMRRTSA-N

• Saikosaponin B1
IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(3S,4R,4aR,6aR,6bS,8S,8aS,14bS)-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol | CAS Registry Number: 58558-08-0
Synonyms: Saikosapanin B1, CID3085144, beta-D-Galactopyranoside, (3beta,4alpha,16beta)-16,23,28-trihydroxyoleana-11,13(18)-dien-3-yl-6-deoxy-3-O-beta-D-glucopyranosyl-

Molecular Formula: C42H68O13Molecular Weight: 780.981520 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 13

InChIKey: ZXCJHOYFGJUMDY-ASRFRNECSA-N

• Saikosaponin B2
IUPAC Name: (2S,3S,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(3S,4R,6aR,6bR,8R,8aS,14aR,14bS)-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 58316-41-9
Synonyms: AKOS015965153, N1947

Molecular Formula: C42H68O13Molecular Weight: 780.981520 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 13

InChIKey: WRYJYFCCMSVEPQ-DPSCCEPBSA-N

• Salicin
IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol | CAS Registry Number: 138-52-3
Synonyms: salicin, Salicoside, Salicine, D(-)-Salicin, D-( )-Salicin, Salicin (6CI,8CI), Salicyl alcohol glucoside, Spectrum_001230, Spectrum2_000756, Spectrum3_000948, Spectrum4_001058, Spectrum5_000971, Saligenin beta-D-glucopyranoside, Saligenin-beta-D-glucopyranoside, KBioGR_001356, KBioSS_001710, MLS000563050, MLS001306490, DivK1c_000030, S0625_SIGMA

Molecular Formula: C13H18O7Molecular Weight: 286.277820 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: NGFMICBWJRZIBI-UJPOAAIJSA-N

• Salidroside
IUPAC Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4,5-triol | CAS Registry Number: 10338-51-9
Synonyms: Rhodioloside, Rhodosin, Tyrosol glucoside, Ambap2363, Glucopyranoside, p-hydroxyphenethyl, MEGxp0_000478, ACon1_000366, CID159278, NCGC00169145-01, LS-71547, 2-(4-Hydroxyphenyl)ethyl beta-D-glucopyranoside, beta-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl, C06046, p-Hydroxyphenethyl alcohol 1-O-beta-D-glucoside

Molecular Formula: C14H20O7Molecular Weight: 300.304400 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: ILRCGYURZSFMEG-RKQHYHRCSA-N

• Salvianolic acid B
IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-[(2R,3R)-2-(3,4-dihydroxyphenyl)-4-[(E)-3-[(2R)-3-(3,4-dihydroxyphenyl)-1-hydroxy-1-oxopropan-2-yl]oxy-3-oxoprop-1-enyl]-7-hydroxy-2,3-dihydro-1-benzofuran-3-carbonyl]oxypropanoic acid | CAS Registry Number: 115939-25-8
Synonyms: Lithospermic acid B, CID6441188, C076944, (2R-(2alpha,3beta(R*),4(E(R*))))-3-(1-Carboxy-2-(3,4-dihydroxyphenyl)ethyl) 4-(3-(1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy)-3-oxo-1-propenyl)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-7-hydroxy-3-benzofurancarboxylate, 3-Benzofurancarboxylic acid, 4-(3-(1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy)-3-oxo-1-propenyl)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-7-hydroxy-, 3-(1-carboxy-2-(3,4-dihydroxyphenyl)ethyl) ester, (2R-(2alpha,3beta(R*),4(E(R*))))-

Molecular Formula: C36H30O16Molecular Weight: 718.613800 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 16

InChIKey: SNKFFCBZYFGCQN-RDHSGEKBSA-N

• Sanguinarine
Synonyms: SANGUINARINE, Sanguinarin, sangvinarin, Sanguiritrin, Veadent, Viadent, Pseudochelerythrine, nchembio.105-comp3, nchembio.123-comp3, Spectrum_000259, Prestwick0_000987, Prestwick1_000987, Prestwick2_000987, Prestwick3_000987, Spectrum2_000724, Spectrum3_001148, Spectrum4_001838, Spectrum5_000635, Lopac-S-5890, Benzophenanthridine alkaloid

Molecular Formula: C20H14NO4+Molecular Weight: 332.329460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: INVGWHRKADIJHF-UHFFFAOYSA-N

• Sarsasapogenin
Synonyms: Parigenin, Sarsapogenine, (25S)-5beta-Spirostan-3beta-ol, CHEBI:15578, NSC 1615, EINECS 204-776-3, (3beta,5beta,25S)-spirostan-3-ol, LS-193826, 5beta-Spirostan-3beta-ol, (25S)- (8CI), C03963, Spirostan-3-ol, (3beta,5beta,25S)- (9CI)

Molecular Formula: C27H44O3Molecular Weight: 416.636460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GMBQZIIUCVWOCD-WWASVFFGSA-N

• Schisandrin B
Synonyms: Schizandrin B, Wuweizisu B, gamma-Schisandrin, Gamma-schizandrin, gomisin N, CHEBI:581434, CID108130, NCGC00163663-01, LS-33970, Benzo(3,4)cycloocta(1,2-f)(1,3)benzodioxole, 5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethyl-, stereoisomer, 64121-95-5, 66211-45-8

Molecular Formula: C23H28O6Molecular Weight: 400.464820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: RTZKSTLPRTWFEV-UHFFFAOYSA-N

• Sclareolide
IUPAC Name: 3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][1]benzofuran-2-one | CAS Registry Number: 564-20-5
Synonyms: Norambreinolide, 12-Norambreinolide, Norambreinolide, (+)-, Decahydrotetramethylnaphthofuranone, EINECS 209-269-0, EINECS 214-933-8, BAS 00434177, 3a,6,6,9a-Tetramethyl-decahydro-naphtho[2,1-b]furan-2-one, 3a,6,6,9a-Tetramethyldecahydronaphtho[2,1-b]furan-2(1H)-one, Decahydro-3a,6,6,9a-tetramethylnaphtho(2,1-b)furan-2(1H)-one, Naphtho(2,1-b)furan-2(1H)-one, decahydro-3a,6,6,9a-tetramethyl-, NAPHTHO 2,1-B FURAN-2(1H)-ONE, DECAHYDRO-3A,6,6,9A-TETRAMETHYL-,, 1-Naphthaleneacetic acid, decahydro-2-hydroxy-2,5,5,8a-tetramethyl-, gamma-lactone, Naphtho(2,1-b)furan-2(1H)-one, decahydro-3a,6,6,9a-tetramethyl-, (3aR,5aS,9aS,9bR)-, Naphtho[2,1-b]furan-2(1H)-one, decahydro-3a,6,6,9a-tetramethyl-, (3as,5as,9as,9br)-, (3AR-(3aalpha,5abeta,9aalpha,9bbeta))decahydro-3a,6,6,9a-tetramethylnaphth(2,1-b)furan-2(1H)-one, 1216-84-8, 3a,4,5,5aalpha,6,7,8,9,9a,9balpha-decahydro-3abeta,6,6,9abeta-tetramethylnaphtho(2,1-b)furan-2(1H)-one, Naphtho(2,1-b)furan-2(1H)-one, 3a,4,5,5aalpha,6,7,8,9,9a,9balpha-decahydro-3abeta,6,6,9abeta-tetramethyl-, Naphtho(2,1-b)furan-2(1H)-one, decahydro-3a,6,6,9a-tetramethyl-, (3aR-(3aalpha,5abeta,9aalpha,9bbeta))-

Molecular Formula: C16H26O2Molecular Weight: 250.376440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IMKJGXCIJJXALX-UHFFFAOYSA-N

• Scopoletin
IUPAC Name: 7-hydroxy-6-methoxychromen-2-one | CAS Registry Number: 92-61-5
Synonyms: scopoletin, Gelseminic acid, Chrysatropic acid, Scopoletine, 6-Methylesculetin, Murrayetin, Scopoletol, Escopoletin, Methylesculetin, 6-O-Methylesculetin, beta-Methylesculetin, Chrysotropic Acid, Acid, Gelseminic, Acid, Chrysotropic, 6-Methoxy-7-hydroxycoumarin, 6-Methoxyumbelliferone, .beta.-Methylesculetin, Esculetin 6-methyl ether, 7-Hydroxy-6-methoxycoumarin, Esculetin-6-methyl ether

Molecular Formula: C10H8O4Molecular Weight: 192.168120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RODXRVNMMDRFIK-UHFFFAOYSA-N

• Scutellarein
IUPAC Name: 5,6,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 529-53-3
Synonyms: Isocarthamidin, Flavonoid, 6-Hydroxyapigenin, 4',5,6,7-Tetrahydroxyflavanone, AIDS000486, AIDS-000486, ZINC00899075, CID5281697, LS-39816, ST5331621, C10184, 4H-1-Benzopyran-4-one, 5,6,7-trihydroxy-2-(4-hydroxyphenyl)-, 5,6,7-Trihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

Molecular Formula: C15H10O6Molecular Weight: 286.236300 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: JVXZRQGOGOXCEC-UHFFFAOYSA-N

• Sennoside B
IUPAC Name: (9S)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | CAS Registry Number: 128-57-4
Synonyms: SENNOSIDE B (SENNA), EINECS 204-895-0, NSC 112930, C42H38O20, LMPK02000052, LS-2100, ST075008, C13526

Molecular Formula: C42H38O20Molecular Weight: 862.739120 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 20

InChIKey: IPQVTOJGNYVQEO-AIFLABODSA-N

• Sesamin
IUPAC Name: 5-[(1S,3aR,4S,6aR)-4-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-1-yl]-1,3-benzodioxole | CAS Registry Number: 607-80-7
Synonyms: sesamin, Asarinin, Fagarol, Sezamin, Episesamin, d-Sesamin, (+)-Sesamin, D-(+)-Sesamin, (+)-Segamin, Ambap957, PSEUDO CUBEBIN, MLS000728578, S9314_SIGMA, ACon0_000323, ACon1_002421, NSC 36403, AIDS002473, AIDS-002473, C20H18O6, CID72307

Molecular Formula: C20H18O6Molecular Weight: 354.353320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: PEYUIKBAABKQKQ-AFHBHXEDSA-N

• Shionone
IUPAC Name: (1R,4bS,6aS,8R,10aR,12aS)-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methylpent-3-enyl)-1,3,4,4a,5,6,7,9,10,10b,11,12-dodecahydrochrysen-2-one | CAS Registry Number: 10376-48-4
Synonyms: CID122861, D:A-Friedo-18,19-secolup-19-en-3-one

Molecular Formula: C30H50OMolecular Weight: 426.717400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HXPXUNQUXCHJLL-PYOYDRRISA-N

• Sibutramine hydrochloride
IUPAC Name: 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine hydrate hydrochloride | CAS Registry Number: 125494-59-9
Synonyms: Meridia, sibutramine, Reductil, Meridia (TN), SIBUTRAMINE HCl, Ambap2725, Sibutramine hydrochloride monohydrate, C17H26ClN.HCl.H2O, HSDB 7209, Sibutramine hydrochloride [USAN], KES-524, Sibutramine hydrochloride (USAN), BTS 54524, BTS-54524, Sibutramine Hydrochloride (monohydrate), CPD000472527, SAM001246592, LS-172628, D02571, (+-)-1-(p-Chlorophenyl)-alpha-isobutyl-N,N-dimethylcyclobutanemethylamine hydrochloride monohydrate

Molecular Formula: C17H29Cl2NOMolecular Weight: 334.324260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KFNNPQDSPLWLCX-UHFFFAOYSA-N

• Sildenafil
IUPAC Name: 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one | CAS Registry Number: 139755-83-2
Synonyms: sildenafil, Sildenafil citrate, 1udt, 1xos, VIAGRA, Ambap1012, Spectrum_001555, SpecPlus_000798, Sildenafil [INN:BAN], Spectrum2_001648, Spectrum3_001892, Spectrum4_000586, Spectrum5_001508, BSPBio_003424, KBioGR_001052, KBioSS_002035, MLS001240224, MLS001304737, DivK1c_006894, SPECTRUM1504099

Molecular Formula: C22H30N6O4SMolecular Weight: 474.576400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: BNRNXUUZRGQAQC-UHFFFAOYSA-N

• Sildenafil citrate
IUPAC Name: 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one; 2-hydroxypropane-1,2,3-tricarboxylic acid | CAS Registry Number: 171599-83-0
Synonyms: Revatio, VIAGRA, Penegra, Patrex, Revatio (TN), Wan Ai Ke, Viagra (TN), Ambap5516, Sildenafil citrate [USAN], Sildenafil citrate (JAN/USAN), IUK-92,480, SL-00761, UK 92480-10, UK-92480, LS-111685, UK-92480-10, D02229, 1-((3-(6,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methylpiperazine citrate (1:1), Piperazine, 1-((3-(6,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), 1-((3-(6,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methyl-,2-hydroxy-1,2,3-propanetricarboxylate

Molecular Formula: C28H38N6O11SMolecular Weight: 666.699920 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 16

InChIKey: DEIYFTQMQPDXOT-UHFFFAOYSA-N

• Silychristin
IUPAC Name: (2R,3R)-3,5,7-trihydroxy-2-[(2R,3S)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrochromen-4-one | CAS Registry Number: 33889-69-9
Synonyms: Silicristin, Silicristinum, Silicristina, Silicristine, Silicristin [INN], Silicristine [INN-French], Silicristinum [INN-Latin], Silicristina [INN-Spanish], UNII-LK279ER14X, EINECS 251-720-9, CHEBI:319529, CID441764, LS-182415, C08717, 2-(2,3-Dihydro-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-benzofuranyl)-3,5,7-trihydroxy-4-chromanone, (2R,3R)-3,5,7-Trihydroxy-2-[(2R,3S)-7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-hydroxymethyl-2,3-dihydro-benzofuran-5-yl]-chroman-4-one

Molecular Formula: C25H22O10Molecular Weight: 482.436180 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: BMLIIPOXVWESJG-LMBCONBSSA-N

• Sinomenine
Synonyms: Cucoline, Kukoline, Coculine, cuculine, Sabianine A, COCCULINE, Spectrum2_001242, Spectrum3_001134, Spectrum4_001981, Spectrum5_001621, UPCMLD-DP085, sinomenine A bismethyliodide, CCRIS 1550, BSPBio_002627, KBioGR_002508, SPECTRUM1505253, SPBio_001144, 365602_ALDRICH, STOCK1N-06056, UPCMLD-DP085:001

Molecular Formula: C19H23NO4Molecular Weight: 329.390220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: INYYVPJSBIVGPH-QHRIQVFBSA-N

• SODIUM SALT,HYDRATE
Synonyms: DB-050248

Molecular Formula: C8H9NNaO5SMolecular Weight: 254.220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HYZJXBVPKNQNJL-UHFFFAOYSA-N

• Sophocarpine
Synonyms: (-)-Sophocarpine, 13,14-Didehydromatridin-15-one, 78003-71-1 (hydrobromide), CHEBI:440766, MolPort-002-507-290, STK801894, AIDS122681, Matridin-15-one, 13,14-didehydro-, AIDS-122681, CID115269, NCGC00160217-01, 145572-44-7 (MONOHYDRATE), LS-145656, Matridin-15-one, 13,14-didehydro- (9CI), 1H,5H,10H-Dipyrido(2,1-f:3',2',1'-ij)(1,6)naphthyridin-10-one, 2,3,6,7,7a,8,13,13a,13b,13c-decahydro-, (7aS,13aR,13bR,13cS)-, (-)-(7aS,13aR,13bR,13cS)-2,3,6,7,7a,8,13,13a,13b,13c-Decahydro-1H,5H,10H-dipyrido[2,1-f:3,2,1-ij][1,6]naphthyridin-10-one

Molecular Formula: C15H22N2OMolecular Weight: 246.347980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AAGFPTSOPGCENQ-JLNYLFASSA-N

• Sophocarpine monohydrate
Synonyms: AK-33305, (41S,7aS,13aR,13bR)-2,3,5,6,7,7a,8,13,13a,13b-Decahydro-1H-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10(41H)-one hydrate

Molecular Formula: C15H24N2O2Molecular Weight: 264.363260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FBOREIYHDGYUFA-PUILLJIJSA-N

• Sophoridine
Synonyms: Sophoridin, l-Sophoridine, Matrine, 5-Epidihydrosophocarpine, Dihydro-5-episophocarpine, (5-beta)-Matridin-15-one, (5beta)-matridin-15-one, Bio-0637, Matridin-15-one, (5-beta)-, MolPort-002-507-291, CID165549, STK801895, Matridin-15-one, (5-beta)- (9CI), LS-145665, TL8004825

Molecular Formula: C15H24N2OMolecular Weight: 248.363860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZSBXGIUJOOQZMP-BHPKHCPMSA-N

• Stachydrine
IUPAC Name: (2S)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate | CAS Registry Number: 471-87-4
Synonyms: stachydrine, proline betaine, L-proline betaine, Prestwick-08G03, N,N-dimethyl-L-proline, CHEBI:35280, EINECS 207-445-1, CID115244, ZINC02528042, (S)-2-Carboxylato-1,1-dimethylpyrrolidinium, NCGC00016999-01, NCGC00163626-01, NCGC00163626-02, AB00514653, (2S)-1,1-dimethylpyrrolidinium-2-carboxylate, C10172, Pyrrolidinium, 2-carboxy-1,1-dimethyl-, inner salt, (2S)-

Molecular Formula: C7H13NO2Molecular Weight: 143.183620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CMUNUTVVOOHQPW-LURJTMIESA-N

• Stevioside
Synonyms: Diterpene glycoside, STOCK1N-63856, CHEBI:543398, MolPort-002-532-754, AIDS002659, AIDS-002659, CID442089, C09189, I06-1318, 1-O-{(5beta,8alpha,9beta,10alpha,13alpha)-13-[(2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-18-oxokaur-16-en-18-yl}-beta-D-glucopyranose, 13-[(2-O-.beta.-D-Glucopyranosyl-.alpha.-D-glucopyranosyl)oxy]kaur-16-en-18-oic acid .beta.-D-glucopyranosyl ester

Molecular Formula: C38H60O18Molecular Weight: 804.872200 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 18

InChIKey: UEDUENGHJMELGK-HYDKPPNVSA-N

• STROPHANTHIN K
IUPAC Name: (14R)-5,14-dihydroxy-3-[(2R,4R,6R)-4-methoxy-6-methyl-5-[(1S,2S,3R,4S,5S)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde | CAS Registry Number: 11005-63-3
Synonyms: Eustrophinum, Strophantin, Combetin, Kombetin, Strophanthin K, Kombe-strophanthin, K-strophantin, STROPHANTHIN, K-STROPHANTHIN, EINECS 234-239-9, C35H52O14, LS-147099, 12671-69-1, 8001-51-2

Molecular Formula: C37H56O13Molecular Weight: 708.832740 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 13

InChIKey: ICLVTBHPYDRXBN-MAXQWQMNSA-N

• Strychnine
Synonyms: strychnine, Strychnin, Strychnidin-10-one, NCIStruc1_001823, NCIStruc2_000542, (−)-Strychnine, S0532_SIGMA, 45661_RIEDEL, MEGxp0_001768, CHEBI:28973, BB_NC-0734, CID441071, PDSP2_000441, SBB006463, ST057252, C06522, InChI=1/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H, STR

Molecular Formula: C21H22N2O2Molecular Weight: 334.411580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QMGVPVSNSZLJIA-FVWCLLPLSA-N

• Swertiamarin
IUPAC Name: (4aR,5R,6S)-5-ethenyl-4a-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-1-one | CAS Registry Number: 17388-39-5
Synonyms: MEGxp0_000871, ACon1_000546, NCGC00168975-01, TL8001379, C09800

Molecular Formula: C16H22O10Molecular Weight: 374.339880 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: HEYZWPRKKUGDCR-QBXMEVCASA-N

• Synephrine
IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]phenol | CAS Registry Number: 94-07-5
Synonyms: Oxedrine, p-Synephrine, Sympatol, Sympaethamine, Parasympatol, Analeptin, Sympathol, Synephrin, Synthenate, Simpalon, Simpatol, p-Oxedrine, Sympaethamin, Ethaphene, l-Synephrine, l-Sympatol, Synefrin [Czech], (+)-Synephrine, (-)-Synephrine, D(-)-Synephrine

Molecular Formula: C9H13NO2Molecular Weight: 167.205020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: YRCWQPVGYLYSOX-UHFFFAOYSA-N

• T-Butylglycine
IUPAC Name: (2R)-2-azaniumyl-3,3-dimethylbutanoate | CAS Registry Number: 33105-81-6
Synonyms: ZINC00389551

Molecular Formula: C6H13NO2Molecular Weight: 131.172920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NPDBDJFLKKQMCM-BYPYZUCNSA-N

• Taltirelin
IUPAC Name: (4S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide | CAS Registry Number: 103300-74-9
Synonyms: Ceredist, Taltirelin hydrate, C17H23N7O5.H2O, TA 0910, TA-0910, NCGC00181033-01, LS-118853, LS-187218, (1-methyl-4,5-dihydroorotyl)-histidyl-prolinamide, (-)-N-(((S)-Hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-L-prolinamide, L-Prolinamide, N-(((4S)-hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-, L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-, (S)-, L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-,(S)-, hydrate (1:4)

Molecular Formula: C17H23N7O5Molecular Weight: 405.408420 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: LQZAIAZUDWIVPM-SRVKXCTJSA-N

• Tanshinone I
IUPAC Name: 1,6-dimethylnaphtho[1,2-g][1]benzofuran-10,11-dione | CAS Registry Number: 568-73-0
Synonyms: Tanshinone, Tanshinon I, Tanshinone A, Tanshinone IIb, Tanshinone IIA, tanshinone II A, tanshinone II B, MLS000697676, TTE-50, BB_NC-1754, C18H12O3, CID114917, SMR000445578, 1,6-Dimethylphenanthro(1,2-b)furan-10,11-dione, LS-175777, Phenanthro(1,2-b)furan-10,11-dione, 1,6-Dimethyl-, C021751, Phenanthro[1,2-b]furan-10,11-dione, 1,6-dimethyl-, 54693-68-4

Molecular Formula: C18H12O3Molecular Weight: 276.286080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AIGAZQPHXLWMOJ-UHFFFAOYSA-N

• Tanshinone IIA
IUPAC Name: 1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione | CAS Registry Number: 568-72-9
Synonyms: Tanshinon II, Tanshinone B, Tanshinone II, Dan Shen Ketone, Tanshinone ?A, tanshinone II A, Ambap896, BSPBio_001597, BSPBio_002426, KBioGR_000317, KBioSS_000317, MLS001048863, SPECTRUM1505824, KBio2_000317, KBio2_002885, KBio2_005453, KBio3_000633, KBio3_000634, NSC686519, AIDS150197

Molecular Formula: C19H18O3Molecular Weight: 294.344420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HYXITZLLTYIPOF-UHFFFAOYSA-N

• Tectoridin
IUPAC Name: 5-hydroxy-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: 611-40-5
Synonyms: Shekanin, Tectoridin (7CI,8CI), BRN 0068384, ZINC04098747, CID5281810, LS-39677, 4',5-Dihydro-6-methoxy-7-(o-glucoside)isoflavone, C10533, 4-18-00-03312 (Beilstein Handbook Reference), 4H-1-Benzopyran-4-one, 7-(beta-D-glucopyranosyloxy)-5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-

Molecular Formula: C22H22O11Molecular Weight: 462.403480 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: CNOURESJATUGPN-UDEBZQQRSA-N

• Tegaserod
IUPAC Name: 1-[[(Z)-[5-(hydroxymethyl)indol-3-ylidene]methyl]amino]-2-pentylguanidine | CAS Registry Number: 145158-71-0
Synonyms: Zelmac, Tegaserod maleate, SDZ HTF 919, HTF 919, Tegaserod [USAN:INN:BAN], SDZ HTF-919, C16H23N5O, UNII-458VC51857, 189188-57-6 (maleate), PDSP1_001758, PDSP2_001741, CID5487301, DB01079, LS-173236, LS-187366, L001192, 1-(((5-Methoxyindol-3-yl)methylene)amino)-3-pentylguanidine, Hydrazinecarboximidamide, 2-((5-methoxy-1H-indol-3-yl)methylene)-N-pentyl-, 1-[[(Z)-[5-(hydroxymethyl)indol-3-ylidene]methyl]amino]-2-pentylguanidine, 5-methoxyindol-3-carboxaldehyde amino(pentylamino)methylenehydrazone hydrogenmaleate

Molecular Formula: C16H23N5OMolecular Weight: 301.386720 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: URPUECXJHQGUDU-JLHYYAGUSA-N

• Telmisartan
IUPAC Name: 2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid | CAS Registry Number: 144701-48-4
Synonyms: Micardis, Kinzalmono, Pritor, Micardis HCT, Micardis (TN), Telmisartan [INN], BIBR 277SE, BIBR 277, Spectrum2_001976, Spectrum3_001089, Spectrum4_001261, Spectrum5_001053, Telmisartan [USAN:INN], BIBR-277, BSPBio_002738, KBioGR_001842, MLS000759432, MLS001076687, BIBR-277-SE, SPECTRUM1505261

Molecular Formula: C33H30N4O2Molecular Weight: 514.616900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: RMMXLENWKUUMAY-UHFFFAOYSA-N


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