化学式

CAS号

6009-98-9

IUPAC Name

钠;2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-二羟基-10,13-二甲基-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-环戊并[a]菲-17-基]丁酰基]氨基]乙磺酸 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]ethanesulfonic acid

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/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-;/m1./s1

InChI Key

IYPNVUSIMGAJFC-HLEJRKHJSA-N

Canonical SMILES

CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C.[Na+]

别名

• NSC681055
• NSC-681055
• Taurine,7.alpha.-dihydroxy-5.beta.-cholan-24-oyl)- sodium salt
• Ethanesulfonic acid,5.beta.,7.alpha.)-3,7-dihydroxy-24-oxocholan-24-y]amino]-, sodium salt