Test
CAS: 207614-05-9 Molecular Formula: C26H42NNaO6 Molecular Weight (g/mol): 487.61 MDL Number: MFCD09037360 InChI Key: OABYVIYXWMZFFJ-XIMBWSGONA-M Synonym: glycocholic acid sodium salt hydrate,sodium glycocholate hydrate,c26h42no6.na.2h2o,sodium glycocholate dihydrate PubChem CID: 45051920 IUPAC Name: sodium;2-[[(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]amino]acetate;dihydrate SMILES: [Na+].[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(=O)NCC([O-])=O
PubChem CID | 45051920 |
---|---|
CAS | 207614-05-9 |
Molecular Weight (g/mol) | 487.61 |
MDL Number | MFCD09037360 |
SMILES | [Na+].[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(=O)NCC([O-])=O |
Synonym | glycocholic acid sodium salt hydrate,sodium glycocholate hydrate,c26h42no6.na.2h2o,sodium glycocholate dihydrate |
IUPAC Name | sodium;2-[[(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]amino]acetate;dihydrate |
InChI Key | OABYVIYXWMZFFJ-XIMBWSGONA-M |
Molecular Formula | C26H42NNaO6 |