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Shanghai Techwell Biopharmaceutical Co., Ltd.

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Contact: Mr. Jin - Sales Dept
Web: http://www.techwell-cn.com
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Address: 4258#, Jindu Road, Shanghai 201108, China
Phone: +86-(21)-54831973 | Fax: +86-(21)-23010563 | Map/Directions >>

Profile: Shanghai Techwell Biopharmaceutical Co., Ltd. specializes in the research and development of biochemical bulks, fermentation bulks and chemosynthesis APIs. Our prostaglandins include (-)-corey lactone diol, (-)-corey lactone 4-phenylbenzoate, unoprostone, misoprostol, beraprost sodium, dinoprostone, bimatoprost, (+)-closprostenol and treprostinil. We also offer casporfungin, anidulafungin, voglibose, docetaxel, entecavir, abacavir and echinocandin B.

42 Products/Chemicals (Click for related suppliers)  
• 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
IUPAC Name: [(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methanol; sulfuric acid | CAS Registry Number: 188062-50-2
Synonyms: Abacavir sulfate, Ziagen, Ziagen (TN), 1592U89 sulfate, Abacavir sulfate (JAN/USAN), CHEBI:2361, D00891, bis({(1S,4R)-4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]cyclopent-2-en-1-yl}methanol) sulfate

Molecular Formula: C28H38N12O6SMolecular Weight: 670.743120 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 18

InChIKey: WMHSRBZIJNQHKT-FFKFEZPRSA-N

• Aliskiren hemifumarate
IUPAC Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide; (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide; (E)-but-2-enedioic acid | CAS Registry Number: 173334-58-2
Synonyms: Tekturna, Enviage, Rasilez, Riprazo, Sprimeo, Aliskiren fumarate, Tekturna (TN), Aliskiren fumarate (JAN), SPP-100B, SPP-100, CGP-60536B, CGP-60536, D06412

Molecular Formula: C64H110N6O16Molecular Weight: 1219.588800 [g/mol]
H-Bond Donor: 10H-Bond Acceptor: 18

InChIKey: KLRSDBSKUSSCGU-KRQUFFFQSA-N

• Alprostadil
IUPAC Name: 7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid | CAS Registry Number: 745-65-3
Synonyms: alprostadil, Prostaglandin E1, Befar, Prostandin, Prostavasin, Caverject, Topiglan, Femprox, Sugiran, Viridal, Alista, Prink, Edex, Muse, FemLife, Prostin VR, Alprox-TD, PGE1, PGE1 Oligomer, Befar (TN)

Molecular Formula: C20H34O5Molecular Weight: 354.480960 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: GMVPRGQOIOIIMI-DWKJAMRDSA-N

• Anidulafungin
Synonyms: Eraxis, Eraxis (TN), Anidulafungin (USAN), D03211

Molecular Formula: C58H73N7O17Molecular Weight: 1140.236920 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 17

InChIKey: JHVAMHSQVVQIOT-SYUWSXCKSA-N

• Anti Fungal Drugs
• Aptivus
IUPAC Name: N-[3-[(1R)-1-[(2R)-6-hydroxy-4-oxo-2-phenethyl-2-propyl-3H-pyran-5-yl]propyl]phenyl]-5-(trifluoromethyl)pyridine-2-sulfonamide | CAS Registry Number: 174484-41-4
Synonyms: Tipranavir, 1d4y, 2o4l, 2o4n, 2o4p, AIDS032941, PNU-140690, AIDS-032941, CID65027, PNU-140690E, DB00932, PNU 140690, 191150-83-1 (DISODIUM SALT), U-140690, U 140690, TPV, 2-Pyridinesulfonamide, N-(3-((1R)-1-((6R)-5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl)propyl)phenyl)-5-(trifluoromethyl)-, 2-Pyridinesulfonamide, N-(3-(1-(5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl)propyl)phenyl)-5-(trifluoromethyl)-, (R-(R*,R*))-, 2-Pyridinesulfonamide, N-[3-[(1R)-1-[(6R)-5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl]propyl]phenyl]-5-(trifluoromethyl)-, N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE

Molecular Formula: C31H33F3N2O5SMolecular Weight: 602.664330 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: NZPXPXAGXYTROM-FYBSXPHGSA-N

• Atazanavir Sulfate
IUPAC Name: methyl N-[(2S)-1-[[(2S,3S)-3-hydroxy-4-[[[(2S)-2-(methoxycarbonylamino)-3,3-dimethylbutanoyl]amino]-[(4-pyridin-2-ylphenyl)methyl]amino]-1-phenylbutan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate; sulfuric acid | CAS Registry Number: 229975-97-7
Synonyms: Reyataz, Atazanavir sulfate, Zrivada, Atanazavir sulfate, Reyataz (TN), Atazanavir sulfate [USAN], Atazanavir sulfate (JAN/USAN), BMS-232632-05, CGP-73547, CID158550, BMS-232632, LS-186585, D01276, 2,5,6,10,13-Pentaazatetradecanedioic acid, 3,12-bis(1,1-dimethylethyl)-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-((4-(2-pyridinyl)phenyl)methyl)-, dimethyl ester, (3S,8S,9S,12S)-, sulfate (1:1) (salt), 2,5,6,10,13-Pentaazatetradecanedioic acid, 3-12-bis(1,1-dimethylethyl)-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-((-4-(2-pyridinyl)phenyl)methyl)-, dimethyl ester, (3S,8S,9S,12S)-, sulfate (1:1) (salt), Dimethyl (3S,8S,9S,12S)-9-benzyl-3,12,di-tert-butyl-8-hydroxy-4,11-dioxo-6-(p-2-pyridylbenzyl)-2,5,6,10,13-pentaazatetradecanedioate, sulfate (1:1) (salt)

Molecular Formula: C38H54N6O11SMolecular Weight: 802.933960 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 13

InChIKey: DQSGVVGOPRWTKI-QVFAWCHISA-N

• Beraprost Sodium
IUPAC Name: 4-[2-hydroxy-1-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoic acid | CAS Registry Number: 88475-69-8
Synonyms: beraprost, Beraprost [USAN:INN], Beraprostum [INN-Latin], TRK 100, TRK-100, MDL 201229, C24H30O5, ML 1229, CID5282428, LS-57736, (+-)-(1R,2R,3aS,8bS)-2,3,3a,8b-Tetrahydro-2-hydroxy-1-((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-ynyl)-1H-cyclopenta(b)benzofuran-5-butyric acid, 1H-Cyclopenta(b)benzofuran-5-butanoic acid, 2,3,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-, 2-Hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta(b)benzofuran-5-butanoic acid, 1H-Cyclopenta(b)benzofuran-5-butanoic acid, 2,3,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-, monosodium salt, 4-(1,2,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyloct-6-yne-1-enyl)-5-cyclopenta(b)benzofuranyl)butyrate, 88430-50-6

Molecular Formula: C24H30O5Molecular Weight: 398.492000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: CTPOHARTNNSRSR-OUKQBFOZSA-N

• Bimatoprost
IUPAC Name: (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-ethylhept-5-enamide | CAS Registry Number: 155206-00-1
Synonyms: Lumigan, Latisse, Lumigan (TN), Bimatoprost (USAN/INN), Bimataprost [USAN:INN:BAN], AGN 192024, CHEBI:51230, AGN-192024, CID5311027, DB00905, NCGC00181745-01, LS-181817, D02724, (Z)-7-((1R,2R,3R,5S)-3,5-Dihydroxy-2-((1E,3S)-3-hydroxy-5-phenyl-1-pentenyl)cyclopentyl)-N-ethyl-5-heptenamide, 5-Heptenamide, 7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((1E,3S)-3-hydroxy-5-phenyl-1-pentenyl)cyclopentyl)-N-ethyl-, (5Z)-, 5-Heptenamide, 7-(3,5-dihydroxy-2-(3-hydrdoxy-5-phenyl-1-pentenyl)cyclopentyl)-N-ethyl-, (1R-(1alpha(Z),2beta(1E,3S*),3alpha,5alpha))-, (5Z)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-5-phenylpent-1-en-1-yl]cyclopentyl}-N-ethylhept-5-enamide, (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-ethylhept-5-enamide, 15M, 267244-98-4

Molecular Formula: C25H37NO4Molecular Weight: 415.565580 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: AQOKCDNYWBIDND-FTOWTWDKSA-N

• Carboprost Tromethamine
IUPAC Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; (E)-7-[(1S,3S,5R)-3,5-dihydroxy-2-[(Z,3S)-3-hydroxy-3-methyloct-1-enyl]cyclopentyl]hept-5-enoic acid | CAS Registry Number: 58551-69-2
Synonyms: Hemabate, carboprost trometamol, Prostin / 15M, CARBOPROST TROMETHAMINE, UNII-U4526F86FJ, Carboprost tromethamine [USAN], C21H36O5, CID6434572, 15(S)15-Methyl pgf2-alpha tromethamine salt, U 32921E, 15-methylprostaglandin F2alpha-tromethamine, LS-125842, 15(S)15-Methyl prostaglandin F2-alpha tromethamine, (15S)-15-Methylprostaglandin F2alpha tromethamine, (15S)-15-Methylprostaglandin F(sub 2alpha) tromethamine, Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-15-methyl-, (5Z,9-alpha,11-alpha,13E,15S)-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), (Z)-7-((1R,2R,3R,5S)-3,5-Dihydroxy-2-((E)-(3S)-3-hydroxy-3-methyl-1-octenyl)cyclopentyl)-5-heptenoic acid compound with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-15-methyl-, (5Z,9-alpha,11-alpha,13E,15S)-,compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)

Molecular Formula: C25H47NO8Molecular Weight: 489.642580 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 9

InChIKey: UMMADZJLZAPZAW-QFXCEMDRSA-N

• Carbovir
IUPAC Name: 2-amino-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one | CAS Registry Number: 118353-05-2
Synonyms: (+-)-Carbovir, CCRIS 2644, NSC614846, CHEBI:202940, NSC 614846, CID72192, GR 90352X, NCGC00014934, NCI60_004955, LS-186880, LS-187535, 2-Amino-9-(4-hydroxymethyl-cyclopent-2-enyl)-9H-purin-6-ol, 2-amino-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-9H-purin-6-ol, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-, cis-(+-)-, 2-Amino-9-(4-hydroxymethyl-cyclopent-2-enyl)-9H-purin-6-ol (Carbovir), Guanine, 9-[4.alpha.-(hydroxymethyl)cyclopent-2-ene-1.alpha.-yl]-,(+-)-cis-, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1R,4S)-4-(hydroxymethyl)-2-cyclopenten-1-yl]-, rel-, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[4-(hydroxymethyl)-2-cyclopenten-1-yl]-, cis-(+-)-

Molecular Formula: C11H13N5O2Molecular Weight: 247.253220 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: XSSYCIGJYCVRRK-UHFFFAOYSA-N

• Caspofungin
Synonyms: Cancidas, Caspofungin [INN], Cancidas (TN), Caspofungin (INN), UNII-F0XDI6ZL63, HSDB 7476, CHEBI:474180, CID151068, LS-186994, LS-187635, D07626, (4R,5S)-5-((2-Aminoethyl)amino)-N(sup 2)-(10,12-dimethyltetradecanoyl)-4-hydroxy-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4-(p-hydroxyphenyl)-L-threonyl-threo-3-hydroxy-L-ornithyl-trans-3-hydroxy-L-proline cyclic (6-1)-peptide

Molecular Formula: C52H88N10O15Molecular Weight: 1093.313120 [g/mol]
H-Bond Donor: 16H-Bond Acceptor: 18

InChIKey: JYIKNQVWKBUSNH-FMIIYRCSSA-N

• Cloprostenol Sodium
IUPAC Name: (Z)-7-[(1R,3R,5S)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoic acid | CAS Registry Number: 55028-72-3
Synonyms: cloprostenol, Estrophane, Oestrophan, Oestrophane, Estrofan, Estrophan, Racemic cloprostenol, (+-)-Cloprostenol, Cloprostenolum [INN-Latin], Cloprostenol [INN:BAN], C22H29ClO6, EINECS 255-028-8, LS-74573, ( -)-(Z)-7-((1R*,2R*,3R*,5S*)-2-((E)-(3R*)-4-(3-Chlorophenoxy-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-5-heptensaeure, 5-Heptenoic acid, 7-((1R,2R,3R,5S)-2-((1E,3R)-4-(3-chlorophenoxy)-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-, (5Z)-rel-, 5-Heptenoic acid, 7-(2-(4-(3-chlorophenoxy)-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-, (1-alpha-(Z),2-beta-(1E,3R*),3-alpha,5-alpha)- (+-)-, 100786-10-5, 40665-92-7, 5-Heptenoic acid, 7-(2-(4-(3-chlorophenoxy)-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-,(1-alpha-(Z),2-beta-(1E,3R*),3-alpha,5-alpha)- (+-)-, 53529-41-2

Molecular Formula: C22H29ClO6Molecular Weight: 424.915060 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: VJGGHXVGBSZVMZ-YAOROIPCSA-N

• Corey Lactone
IUPAC Name: [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate | CAS Registry Number: 39746-00-4
Synonyms: nchembio.128-comp28b, ZINC04261955, TL8002869, (3aR,4S,5R,6aS)-5-(Benzoyloxy)hexahydro-4-(hydroxymethyl)-2H-cyclopentafuran-2-one, 2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)hexahydro-4-(hydroxymethyl)-, (3aR,4S,5R,6aS)-

Molecular Formula: C15H16O5Molecular Weight: 276.284540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: OBRRYUZUDKVCOO-FVCCEPFGSA-N

• Corey Lactone Diol
IUPAC Name: (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one | CAS Registry Number: 32233-40-2
Synonyms: (−)-Corey lactone, 341576_ALDRICH, ZINC04261954, CID2724453, (-)-COREY DIOL (COREY LACTONE), ST075172, TL8002451, (3aR,4S,5R,6aS)-(−)-Hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one

Molecular Formula: C8H12O4Molecular Weight: 172.178480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: VYTZWRCSPHQSFX-GBNDHIKLSA-N

• Daptomycin
Synonyms: DAPTOMYCIN, N-decanoyl-L-tryptophyl-L-asparaginyl-N-[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-ox, N-decanoyl-L-tryptophyl-L-asparaginyl-N-[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonaazacyclohentriacontan-30-yl]-L-alpha-asparagine

Molecular Formula: C72H101N17O26Molecular Weight: 1620.670640 [g/mol]
H-Bond Donor: 22H-Bond Acceptor: 29

InChIKey: DOAKLVKFURWEDJ-RWDRXURGSA-N

• Darunavir
IUPAC Name: [(3R,3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-3-yl] N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate | CAS Registry Number: 206361-99-1
Synonyms: Prezista, Darunavirum, 2idw, 2ien, Darunavir [USAN], TMC-114, Darunavirum [INN-Latin], TMC114, 2f8g, 2hs1, 2hs2, Darunavir (USAN/INN), UIC-94017, TMC 114, AIDS073035, UNII-YO603Y8113, 2f80, 2f81, AIDS-073035, CID213039

Molecular Formula: C27H37N3O7SMolecular Weight: 547.663580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: CJBJHOAVZSMMDJ-HEXNFIEUSA-N

• Dinoprost
IUPAC Name: (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid | CAS Registry Number: 551-11-1
Synonyms: dinoprost, amoglandin, cyclosin, panacelan, Protamodin, Enzaprost, Enzaprost F, Cerviprost, PGF2alpha, prostaglandin F2alpha, Prostaglandin F2a, Glandin, Prostarmon F, Prostin F2alpha, Estrofan, Prosmon, l-PGF2-alpha, Prostin F2-alpha, PGF-2alpha, PGF2-alpha

Molecular Formula: C20H34O5Molecular Weight: 354.480960 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: PXGPLTODNUVGFL-YNNPMVKQSA-N

• Dinoprostone
IUPAC Name: (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid | CAS Registry Number: 363-24-6
Synonyms: Prostaglandin E2, Dinoproston, Prepidil, Prostin, PGE2, Prostin E2, Cervidil, Glandin, l-Prostaglandin E2, Prepidil Gel, Minprositin E2, Minprostin E2, PGE2alpha, Cervidil (TN), PGE2 alpha, Prepidil (TN), l-PGE2, Prestwick_793, (15S)-Prostaglandin E2, Prostaglandin E2alpha

Molecular Formula: C20H32O5Molecular Weight: 352.465080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: XEYBRNLFEZDVAW-ARSRFYASSA-N

• Docetaxel
Synonyms: docetaxel, Taxotere, Docetaxol, Docetaxel anhydrous, nchembio853-comp8, Docetaxel, Trihydrate, nchembio.2007.34-comp7, 01885_FLUKA, XRP-6976L, ANX-514, SDP-014, DB01248, NSC-628503, RP-56976, SL-00678, C11231, TXL, (2alpha,5beta,7beta,10beta,13alpha)-4-(acetyloxy)-13-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-1,7,10-trihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl (aR,bS)-b-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxybenzenepropanoate

Molecular Formula: C43H53NO14Molecular Weight: 807.879220 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 14

InChIKey: ZDZOTLJHXYCWBA-VCVYQWHSSA-N

• Dorzolamide HCL
IUPAC Name: (4R,6R)-4-(ethylamino)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride | CAS Registry Number: 130693-82-2
Synonyms: Trusopt, Cosopt, dorzolamide, Mixture Name, DORZOLAMIDE HYDROCHLORIDE, Dorzolamide hydrochloride [USAN], C10H16N2O4S3.HCl, MK 0507, MK-0507, MK 507, MK-507, LS-152562, L 671152, L-671,152, (4S,6S)-4-(Ethylamino)-5,6-dihydro-6-methyl-4H-thieno(2,3-b)thiopyran-2-sulfonamide 7,7-dioxide, monohydrochloride, 4H-Thieno(2,3-b)thiopyran-2-sulfonamide, 4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide, monohydrochloride, (4S-trans)-, 4H-Thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-(ethylamino)-6-methyl-, 7,7-dioxide, monohydrochloride, (4S,6S)-, 4-ethylamino-5,6-dihydro-6-methyl-7,7-dioxide-4H-thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-ethylamino-6-methyl-4H-thieno(2,3-b)thiopyran-2-sulfonamide-7,7-dioxide

Molecular Formula: C10H17ClN2O4S3Molecular Weight: 360.900980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: OSRUSFPMRGDLAG-CIRBGYJCSA-N

• Echinocandin B
Synonyms: AKOS015899653, AC-6111, I14-11713

Molecular Formula: C34H51N7O15Molecular Weight: 797.806640 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 16

InChIKey: BLKJKIJFNJAQIZ-UHFFFAOYSA-N

• Entecavir
IUPAC Name: 2-amino-9-[(3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one | CAS Registry Number: 142217-69-4
Synonyms: Baraclude, Entecavir [INN], Entecavir [USAN:INN], HSDB 7334, BMS 200475, CID170343, SQ 34676, NCGC00164563-01, LS-186647, LS-187009, LS-187784, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-

Molecular Formula: C12H15N5O3Molecular Weight: 277.279200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: QDGZDCVAUDNJFG-PPSBICQBSA-N

• Fludarabine
IUPAC Name: [(2R,3S,4S,5R)-5-(6-amino-2-fluoropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | CAS Registry Number: 75607-67-9
Synonyms: fludara, fludarabine phosphate, Fludura, Beneflur, FAMP, FaraAMP, fluoro-ara-AMP, Fludarabine monophosphate, 2-Fluoro-ARA AMP, Fludara (TN), 2-Fluoro-ara-AMP, F-ara-AMP, Ambap1079, Fludarabine 5'-monophosphate, 2-F-ara-AMP, C10H13FN5O7P, Fludarabine phosphate [USAN:BAN], NSC-312887, Fludarabine phosphate (JAN/USP), SHT-586

Molecular Formula: C10H13FN5O7PMolecular Weight: 365.211684 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 13

InChIKey: GIUYCYHIANZCFB-FJFJXFQQSA-N

• Iloprost
IUPAC Name: (5E)-5-[(3aS,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid | CAS Registry Number: 78919-13-8
Synonyms: Ciloprost, Ventavis, ILOPROST, Iloprostum [Latin], Iloprost [BAN:INN], C22H32O4, PDSP2_001536, ZK 36374, CID6435378, NCGC00181784-01, ZK-36374, LS-101845, (16R,S)-Methyl-18,18,19,19-tetradehydro-6a-carbaprostaglandin I(sub 2), (E)-(3aS,4R,5R,6aS)-Hexahydro-5-hydroxy-4-((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-ynyl)-delta(sup 2(1H),delta)-pentalenevaleric acid, (E)-5-(3aS,4R,5R,6aS)-5-Hydroxy-4((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-inyl)perhydropentalen-2-yliden)valeriansaeure, Pentanoic acid, 5-(hexahydro-5-hydroxy-4-(3-hydroxy-4-methyl-1-octen-6-ynyl)-2(1H)-pentalenylidene)-, (5E)-5-[(3aS,5R,6aS)-5-hydroxy-4-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]hexahydropentalen-2(1H)-ylidene]pentanoic acid, 73873-87-7

Molecular Formula: C22H32O4Molecular Weight: 360.487080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: HIFJCPQKFCZDDL-SGSAMSKHSA-N

• Latanoprost
IUPAC Name: propan-2-yl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-5-phenylpentyl]cyclopentyl]hept-5-enoate | CAS Registry Number: 130209-82-4
Synonyms: latanoprost, Xalatan, Xalatan (TN), latanoprost free acid, Ambap5291, PhXA41, PhXA 41, MLS000759468, MLS001424106, L1167_SIGMA, Latanoprost (JAN/USAN/INN), CHEBI:6384, XA41, PhXA34 [as 15(R,S)-isomer], CID5311221, CPD000466354, SAM001246671, SMR000466354, TL8000716, D00356

Molecular Formula: C26H40O5Molecular Weight: 432.592800 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: GGXICVAJURFBLW-CEYXHVGTSA-N

• Methyl 3-hydroxybutanoate
IUPAC Name: methyl 3-hydroxybutanoate | CAS Registry Number: 3976-69-0
Synonyms: Methyl 3-hydroxybutyrate, Methyl-3-hydroxybutyrate, Methyl (R)-3-hydroxybutyrate, Methyl (S)-3-hydroxybutyrate, EINECS 216-068-1, Methyl (S)-(+)-3-hydroxybutyrate, (R)-(-)-Methyl 3-hydroxybutyrate, EINECS 223-610-0, EINECS 258-628-8, Methyl (R)-(-)-3-hydroxybutyrate, BUTYRIC ACID, 3-HYDROXY-, METHYL ESTER, Butanoic acid, 3-hydroxy-, methyl ester, LS-48063, Butanoic acid, 3-hydroxy-, methyl ester, (S)-, 1487-49-6, 53562-86-0

Molecular Formula: C5H10O3Molecular Weight: 118.131100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LDLDJEAVRNAEBW-UHFFFAOYSA-N

• Micafungin
Synonyms: Micafungin [INN], UNII-R10H71BSWG, CHEBI:473847, CID3081921, DB01141, LS-184079, Pneumocandin A0, 1-((4R,5R)-4,5-dihydroxy-N2-(4-(5-(4-(pentyloxy)phenyl)-3-isoxazolyl)benzoyl]-L-ornithine)-4-((4S)-4-hydroxy-4-(4-hydroxy-3-(sulfooxy)phenyl)-L-threonine)-

Molecular Formula: C56H71N9O23SMolecular Weight: 1270.274440 [g/mol]
H-Bond Donor: 16H-Bond Acceptor: 24

InChIKey: PIEUQSKUWLMALL-UHFFFAOYSA-N

• Misoprostol
IUPAC Name: methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoate | CAS Registry Number: 59122-46-2
Synonyms: misoprostol, Cytotec, Arthrotec, Isprelor, Misopess, GyMiso, Cytotec (TN), Ambap991, Misoprostolum [INN-Latin], MLS000028863, M6807_SIGMA, Misoprostol (JAN/USAN/INN), CCRIS 6859, XP-16J, HSDB 3573, Misoprostol [USAN:BAN:INN:JAN], SC-29333, DB00929, BRN 4155643, SMP1_000193

Molecular Formula: C22H38O5Molecular Weight: 382.534120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: OJLOPKGSLYJEMD-URPKTTJQSA-N

• Mizoribine
IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxyimidazole-4-carboxamide | CAS Registry Number: 50924-49-7
Synonyms: mizoribine, Bredinin, Bredinine, Bredinin (TN), Mizoribine [INN:JAN], Mizoribinum [INN-Latin], Mizoribina [INN-Spanish], Mizoribine (JAN/INN), Spectrum2_001559, Spectrum3_000739, Spectrum4_000220, Spectrum5_001671, mizoribine 5'-monophosphate, HE-69, Lopac0_000745, BSPBio_002298, KBioGR_000859, MLS000028813, MLS001076272, DivK1c_000948

Molecular Formula: C9H13N3O6Molecular Weight: 259.216020 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: HZQDCMWJEBCWBR-UUOKFMHZSA-N

• Paclitaxel
Synonyms: paclitaxel, Yewtaxan, TAXOL, Plaxicel, Paxceed, Taxol A, Abraxane, Ebetaxel, Capxol, Paxene, Onxol, TaxAlbin, LipoPac, Genetaxyl, Nanotaxel, Paclical, Pacligel, Anzatax, Genaxol, Genexol

Molecular Formula: C47H51NO14Molecular Weight: 853.906140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 14

InChIKey: RCINICONZNJXQF-MZXODVADSA-N

• Pneumocandin
Synonyms: Pneumocandin Bo, Hydroxy Echinocandin, AIDS008540, AIDS-008540, CID5742645, L-688,786, (2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[2-Carbamoyl-1(R)-hydroxyethyl]-23-[1(S),2(S)-dihydroxy-2-(4-hydroxyphenyl)ethyl]-9-(10,12-dimethyltetradecanamido)-2,11,12,15-tetrahydroxy-6-[1(R)-hydroxyethyl]perhydrodipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacycloheneicosine-5,8,14,19,22,25-hexaone

Molecular Formula: C50H80N8O17Molecular Weight: 1065.213600 [g/mol]
H-Bond Donor: 15H-Bond Acceptor: 17

InChIKey: DQXPFAADCTZLNL-ZESADUFFSA-N

• Pneumocandin A0

Molecular Formula: C56H71N9O19Molecular Weight: 1174.211840 [g/mol]
H-Bond Donor: 15H-Bond Acceptor: 20

InChIKey: KQXCDPHUUZMFML-UHFFFAOYSA-N

• Prostaglandin
IUPAC Name: (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid

Molecular Formula: C20H34O5Molecular Weight: 354.480960 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: PXGPLTODNUVGFL-YNNPMVKQSA-N

• Prostaglandins (CAS: 11000-26-3)
• Sitagliptin Phosphate
IUPAC Name: (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one; phosphoric acid; hydrate | CAS Registry Number: 654671-77-9
Synonyms: Januvia, Glactiv, Tesavel, Xelevia, Januvia (TN), Sitagliptin phosphate, Sitagliptin phosphate hydrate, Sitagliptin phosphate monohydrate, Sitagliptin phosphate (USAN), ONO-5435, Sitagliptin phosphate hydrate (JAN), MK-431, MK-0431, D06645

Molecular Formula: C16H20F6N5O6PMolecular Weight: 523.324080 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 16

InChIKey: GQPYTJVDPQTBQC-KLQYNRQASA-N

• Travoprost
IUPAC Name: propan-2-yl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoate | CAS Registry Number: 157283-68-6
Synonyms: Travatan, Travatan Z, Travatanz, Travatan Alcon, Travatan (TN), Travoprost [USAN], Travoprost (JAN/USAN/INN), (+)-Fluprostenol isopropyl ester, C26H35F3O6, AL-6221, AL6221, DB00287, LS-173521, D01964, (((1R)-(1alpha(Z),2beta(1E,3R*),3alpha,5alpha))-7-(3,5-dihydroxy-2-(3-hydroxy-4-(3-trifluoromethyl)phenoxy)-1-butenyl)cyclopentyl)-5-heptenoic acid, 1-methylethyl ester, (1R-(1alpha(Z),2beta(1E,3R*),3alpha,5alpha))-7-(3,5-Dihydroxy-2-(3-hydroxy-4-(3-(trifluoromethyl)phenoxy)-1-butenyl)cyclopentyl)-5-heptenoic acid, 1-methylethyl ester, (Z)-7-((1R,2R,3R,5S)-3,5-Dihydroxy-2-((1E,3R)-3-hydroxy-4-((alpha,alpha,alpha-trifluoro-m-isopropyl-tolyl)oxy)-1-butenyl)cyclopentyl)-5-heptenoate, 5-Heptenoic acid, 7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((1E,3R)-3-hydroxy-4-(3-(trifluoromethyl)phenoxy)-1-butenyl)cyclopentyl)-, 1-methylethyl ester, (5Z)-, 5-Heptenoic acid, 7-(3,5-dihydroxy-2-(3-hydroxy-4-(3-(trifluoromethyl)phenoxy)-1-butenyl)cyclopentyl)-, 1-methylethyl ester, (1R-(1alpha(Z),2beta(1E,3R*),3alpha,5alpha))-, 5-Heptenoic acid,7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((1E,3R)-3-hydroxy-4-(3-(trifluoromethyl)phenoxy)-1-butenyl)cyclopentyl)-,1-methylethyl ester,(5Z)

Molecular Formula: C26H35F3O6Molecular Weight: 500.547710 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: MKPLKVHSHYCHOC-AHTXBMBWSA-N

• Unoprostone
IUPAC Name: propan-2-yl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]hept-5-enoate | CAS Registry Number: 120373-24-2
Synonyms: Rescula, Eescula, isopropyl unoprostone, Rescula (TN), unoprostone isopropyl, Unoprostone isopropyl ester, UF 21 (urethane polymer), Isopropyl unoprostone (JAN), CHEBI:31731, UF 021, UF-021, UF-21, C25H44O5, CID5282175, LS-74384, LS-176760, D01452, isopropyl (5Z,9alpha,11alpha)-9,11-dihydroxy-15-oxo-20a,20b-dihomoprost-5-en-1-oate, isopropyl 20-ethyl-9alpha,11alpha-dihydroxy-15-keto-cis-delta-5-prostanoate, propan-2-yl (5Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]hept-5-enoate

Molecular Formula: C25H44O5Molecular Weight: 424.613860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: XXUPXHKCPIKWLR-JHUOEJJVSA-N

• Voglibose
IUPAC Name: (1S,2S,3R,4S,5S)-5-(1,3-dihydroxypropan-2-ylamino)-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol | CAS Registry Number: 83480-29-9
Synonyms: voglibose, Basen, Glustat, Basen OD, Basen (TN), Ambap5436, Voglibose (JP15/USAN/INN), AO-128, DB04878, TL8005479, D01665, A-71100, (1S,2S,3R,4S,5S)-5-(1,3-dihydroxypropan-2-ylamino)-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol, (1S,2S,3R,4S,5S)-5-{[2-hydroxy-1-(hydroxymethyl)ethyl]amino}-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol

Molecular Formula: C10H21NO7Molecular Weight: 267.276240 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 8

InChIKey: FZNCGRZWXLXZSZ-CIQUZCHMSA-N

• (1R)-(-)-2-Azabicyclo[2.2.1]hept-5-en-3-one
IUPAC Name: (1R,4S)-6-azabicyclo[2.2.1]hept-2-en-5-one | CAS Registry Number: 79200-56-9
Synonyms: ZINC00158453

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DDUFYKNOXPZZIW-UHNVWZDZSA-N

• (-)corey Lactone 4-phenylbenzoate
IUPAC Name: [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate | CAS Registry Number: 31752-99-5
Synonyms: (-)-Corey lactone, nchembio.128-comp29b, TimTec1_004986, 249262_ALDRICH, ZINC04261895, TL8002426, (−)-Corey lactone 5-(4-phenylbenzoate, (−)-Corey lactone, 4-phenylbenzoate alcohol, (3aR,4S,5R,6aS)-Hexahydro-4-hydroxymethyl-5-(4-phenylbenzoyloxy)cyclopenta[b]furan-2-one, (3aalpha,4alpha,5beta,6aalpha)-(−)-Hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl 1,1'-biphenyl-4-carboxylate, (3aR,4S,5R,6aS)-[1,1'-Biphenyl]-4-carboxylic acid, hexahydro-4-(methoxymethyl)-2-oxo-2H-cyclopentafuran-5-yl ester

Molecular Formula: C21H20O5Molecular Weight: 352.380500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SZJVIFMPKWMGSX-AKHDSKFASA-N


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