Produkty 75672-30-9

CAS 75672-30-9 to numer rejestracyjny substancji Ursodeoxycholic Acid-3-O-Beta-D-glucuronide Disodium Salt. Oferty producentów: TRC. Dostępne opakowania: 1mg.

Ursodeoxycholic Acid-3-O-Beta-D-glucuronide Disodium Salt
TRC
  • opakowanie: 1mg
  • Warianty: 1
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Wzór strukturalny: {0} (CAS {1})

Disodium;(2S,3S,4S,5R,6R)-6-[[(3R,5R,7S,8R,9S,10S,13R,14S,17R)-17-[(2R)-4-carboxylatobutan-2-yl]-7-hydroxy-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-carboxylate (CAS 75672-30-9) to związek chemiczny o wzorze sumarycznym C30H46Na2O10 i masie molowej 612.7 g/mol. Nazwa systematyczna IUPAC: disodium;(2S,3S,4S,5R,6R)-6-[[(3R,5R,7S,8R,9S,10S,13R,14S,17R)-17-[(2R)-4-carboxylatobutan-2-yl]-7-hydroxy-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-carboxylate. InChIKey: XBFVKSJQDNGFJD-HDMYGZLOSA-L.

Dane identyfikacyjne
Wzór sumarycznyC30H46Na2O10
Masa molowa612.7 g/mol
Nazwa IUPACdisodium;(2S,3S,4S,5R,6R)-6-[[(3R,5R,7S,8R,9S,10S,13R,14S,17R)-17-[(2R)-4-carboxylatobutan-2-yl]-7-hydroxy-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-carboxylate
InChIKeyXBFVKSJQDNGFJD-HDMYGZLOSA-L
SMILESC[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[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)C.[Na+].[Na+]

Dane obliczone przez PubChem (NCBI)

Synonimy: Ursodeoxycholic Acid-3-O-Beta-D-glucuronide Disodium Salt
Izomery (ten sam wzór sumaryczny)
disodium;(2S,3S,4S,5R,6R)-6-[[(3R,5R,10S,12S,13R,14S,17R)-17-[(2R)-4-carboxylatobutan-2-yl]-12-hydroxy-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-carboxylate C30H46Na2O10