Produkty 76060-22-5

CAS 76060-22-5 to numer rejestracyjny substancji Cholic Acid Glucuronide. Oferty producentów: Chemat Brand. Dostępne opakowania: on request.

Cholic Acid Glucuronide
Chemat Brand
  • opakowanie: on request
  • Warianty: 1
Zobacz produkt
Wzór strukturalny: {0} (CAS {1})

(2S,3S,4S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4-carboxybutan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 76060-22-5) to związek chemiczny o wzorze sumarycznym C30H48O11 i masie molowej 584.7 g/mol. Nazwa systematyczna IUPAC: (2S,3S,4S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4-carboxybutan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: RBLDVEUUCHVWMW-SXYQVCRBSA-N.

Dane identyfikacyjne
Wzór sumarycznyC30H48O11
Masa molowa584.7 g/mol
Nazwa IUPAC(2S,3S,4S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4-carboxybutan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyRBLDVEUUCHVWMW-SXYQVCRBSA-N
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C)O)O)C

Dane obliczone przez PubChem (NCBI)

Synonimy: Cholic acid glucuronide, Cholate glucuronide, 3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid 3-D-glucuronide, 7,12-dihydroxy-3-O-(beta-D-glucopyranosyluronate)-5 beta-cholan-24-oate, Cholic acid 3-o-glucuronide, 7,12-Dihydroxy-3-O-(beta-D-glucopyranosyluronate)-5beta-cholan-24-oate, 7,12-dihydroxy-3-o-(beta-d-glucopyranosyluronate)-5beta-cholan-24-oic acid, 7,12-dihydroxy-3-o-(beta-delta-glucopyranosyluronate)-5beta-cholan-24-oate, 7,12-dihydroxy-3-o-(beta-delta-glucopyranosyluronate)-5beta-cholan-24-oic acid
Izomery (ten sam wzór sumaryczny)
(2S,3S,4S,5R,6R)-6-[[(3R,5R,6S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-4-carboxybutan-2-yl]-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C30H48O11
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]oxyoxane-2-carboxylic acid C30H48O11