Glycocholic Acid 3-O-beta-Glucuronide Disodium Salt

cas: 75672-42-3 — see every product listed under this CAS number, including other names

Glycocholic Acid 3-O-beta-Glucuronide Disodium Salt (CAS 75672-42-3) is a chemical reagent available from Chemat. Available pack sizes: on request, 50mg. Offered by: Chemat Brand, TRC.

brandChemat Brand
catalog numberULC57123
cas75672-42-3
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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Disodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-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-carboxylate (CAS 75672-42-3) is a chemical compound with the molecular formula C33H51NNa2O12 and a molecular weight of 699.7 g/mol. IUPAC name: disodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-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-carboxylate. InChIKey: LTRHJPNIEWJQKP-FXWCFQNQSA-L.

Identity
Molecular formulaC33H51NNa2O12
Molecular weight699.7 g/mol
IUPAC namedisodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-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-carboxylate
InChIKeyLTRHJPNIEWJQKP-FXWCFQNQSA-L
SMILESC[C@H](CCC(=O)NCCC(=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([C@@H]([C@H](O5)C(=O)[O-])O)O)O)C)O)O)C.[Na+].[Na+]

Computed by PubChem (NCBI)

Synonyms: Glycocholic Acid 3-O-beta-Glucuronide Disodium Salt