POTASSIUM TAUROCHOLATE

Molecular Formula: C26H44KNO7S


InChI: InChI=1/C26H45NO7S.K/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);/q;+1/p-1/t15u,16u,17-,18u,19u,20u,21-,22+,24?,25u,26u;/m1./s1/fC26H44NO7S.K/h27H;/q-1;m

InChIKey: InChIKey=DMYWDAAJMXQHLP-MEHOLQDEDM
SMILES: CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[K+]

Names:
    POTASSIUM TAUROCHOLATE
    potassium 2-[4-[(3R,7R,12S)-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]pentanoylamino]ethanesulfonate
    7487-77-6

Registries:
    PubChem CID 24081
    PubChem ID 166605