化学式

CAS号

IUPAC Name

2-aminoethylsulfonyl(2R,6R)-2-甲基-6-[(1R,3S,5S,7R,8S,9S,10S,13R,14S,17R)-1,3,7-三羟基-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]庚酸 2-aminoethylsulfonyl (2R,6R)-2-methyl-6-[(1R,3S,5S,7R,8S,9S,10S,13R,14S,17R)-1,3,7-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]heptanoate

InChI

InChI=1S/C29H51NO7S/c1-17(6-5-7-18(2)27(34)37-38(35,36)13-12-30)21-8-9-22-26-23(10-11-28(21,22)3)29(4)19(15-24(26)32)14-20(31)16-25(29)33/h17-26,31-33H,5-16,30H2,1-4H3/t17-,18-,19+,20+,21-,22+,23+,24-,25-,26+,28-,29+/m1/s1

InChI Key

DEMJAJXEWSIRNJ-ASQAXTEZSA-N

Canonical SMILES

CC(CCCC(C)C(=O)OS(=O)(=O)CCN)C1CCC2C1(CCC3C2C(CC4C3(C(CC(C4)O)O)C)O)C

别名

• Taurine (25R)-1beta,3alpha,7alpha-trihydroxy-26-oxo-5beta-cholestane-26-yl ester