| CAS Number | 6009-98-9 |
| Catalog Number | AG0035MQ(AGN-PC-0SUQAE) |
| Chemical Name | Ethanesulfonic acid, 2-[[(3α,5β,7α)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-, sodium salt (1:1) |
| IUPAC Name | sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-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-17-yl]pentanoyl]amino]ethanesulfonate |
| InChI | InChI=1S/C26H45NO6S.Na/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29;/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-;/m1./s1 |
| InChI Key | IYPNVUSIMGAJFC-HLEJRKHJSA-M |
| MDL Number | MFCD00036745 |
| Molecular Formula | C26H44NNaO6S |
| Molecular Weight | 521.6854 |
| SMILES | C[C@H](CCC(NCCS(=O)([O-])=O)=O)[C@H]1CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C.[Na+] |
| Synonyms | Sodium taurochenodeoxycholate,
6009-98-9,
Taurochenodeoxycholic acid sodium salt,
MFCD00036745,
C26H44NNaO6S,
CHEMBL2028546,
AKOS025290391,
V1536,
3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic acid N-(2-sulfoethyl)amide sodium salt,
2-([3alpha,7alpha-Dihydroxy-24-oxo-5beta-cholan-24-yl]amino)ethanesulfonic acid sodium salt,
Ethanesulfonic acid, 2-[[(3alpha,5beta,7alpha)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-, sodium salt (1:1),
Sodium taurochenodesoxycholate,
C26-H45-N-O6-S.Na,
NSC 681055,
TAUROCHENODEOXYCHOLICACIDSODIUMSALT,
Taurochenodeoxycholic acid sodium salt, 97% - 100MG 100mg,
2-(((3alpha,5beta,7alpha)-3,7-Dihydroxy-24-oxocholan-24-yl)amino)ethanesulfonic acid monosodium salt,
Ethanesulfonic acid, 2-(((3alpha,5beta,7alpha)-3,7-dihydroxy-24-oxocholan-24-yl)amino)-, monosodium salt,
Ethanesulfonic acid, 2-[[(3.alpha.,5.beta.,7.alpha.)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-, monosodium salt,
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