CAS Number
Molecular Formula
C26H45NO7S
Product format
Neat
Molecular Weight
515.71
API Family
Synonyms
Tauro-omega-muricholic acid; T-omega-MCA; N-(3alpha, 6alpha, 7beta-trihydroxy-5beta-cholan-24-oyl)-taurine; TOMCA; RefChem:187524; 130325-58-5; 2-((R)-4-((3R, 5R, 6R, 7R, 8S, 9S, 10R, 13R, 14S, 17R)-3, 6, 7-Trihydroxy-10 and 13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethanesulfonic acid; Tauro-?-muricholic Acid (sodium salt); SCHEMBL29362689; CHEBI:139137
Iupac Name
2-[[(4R)-4-[(3R, 5R, 6R, 7R, 8S, 9S, 10R, 13R, 14S, 17R)-3, 6, 7-trihydroxy-10, 13-dimethyl-2, 3, 4, 5, 6, 7, 8, 9, 11, 12, 14, 15, 16 and 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
InChI
InChI=1S/C26H45NO7S/c1-15(4-7-21(29)27-12-13-35(32,33)34)17-5-6-18-22-19(9-11-25(17,18)2)26(3)10-8-16(28)14-20(26)23(30)24(22)31/h15-20,22-24,28,30-31H,4-14H2,1-3H3,(H,27,29)(H,32,33,34)/t15-,16-,17-,18+,19+,20+,22+,23-,24-,25-,26-/m1/s1
