CAS: 516-50-7 - 2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid
Formula:C26H45NO6S
InChI:InChI=1S/C26H45NO6S/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1
InChI key:InChIKey=AWDRATDZQPNJFN-VAYUFCLWSA-N
SMILES:O=C(NCCS(=O)(=O)O)CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C
- Synonyms:
- 2-[[(3α,5β,12α)-3,12-Dihydroxy-24-oxocholan-24-yl]amino]ethanesulfonic acid
- 3α,12α-Dihydroxy-5β-cholanic acid-24-taurine
- Cholane, ethanesulfonic acid deriv.
- Deoxycholyltaurine
- Deoxytaurocholic acid
- Ethanesulfonic acid, 2-(((3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl)amino)-
- Ethanesulfonic acid, 2-[[(3α,5β,12α)-3,12-dihydroxy-24-oxocholan-24-yl]amino]-
- N-(3a,12a-dihydroxy-5b-cholan-24-oyl)-Taurine
- Taurine, N-(3α,12α-dihydroxy-5β-cholan-24-oyl)-
- Taurodeoxycholic acid
- See more synonyms
- Taurodesoxycholic acid
- Tudcabil