CAS: 14605-22-2 - Tauroursodeoxycholic acid
Formula:C26H45NO6S
InChI:InChI=1S/C26H45NO6S/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)/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-/m1/s1
InChI key:InChIKey=BHTRKEVKTKCXOH-LBSADWJPSA-N
SMILES:O=C(NCCS(=O)(=O)O)CCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
- Synonyms:
- 2-(3Α,7Β-Dihydroxy-5Β-Cholan-24-Amido)Ethanesulfonic Acid
- 2-[[(3α,5β,7β)-3,7-Dihydroxy-24-oxocholan-24-yl]amino]ethanesulfonic acid
- 2-{[(3Alpha,5Beta,7Beta)-3,7-Dihydroxy-24-Oxocholan-24-Yl]Amino}Ethanesulfonic Acid
- 2-{[(3Alpha,5Beta,7Beta,8Xi,9Xi,14Xi)-3,7-Dihydroxy-24-Oxocholan-24-Yl]Amino}Ethanesulfonic Acid
- 3α,7β-Dihydroxy-5β-cholanoyltaurine
- 9,10-Secocholesta-5,7,10-Trien-3-Ol
- Cholane, ethanesulfonic acid deriv.
- Ethanesulfonic acid, 2-[[(3α,5β,7β)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-
- Taurine, N-(3α,7β-dihydroxy-5β-cholan-24-oyl)-
- Taurolite
- See more synonyms
- Taurursodiol
- Ur 906
- Ursodeoxycholyltaurine
- Ursodoxicoltaurine
- Tauroursodeoxycholic acid