Nombre del analito

(3alpha,5alpha,7alpha,12beta)-3,7,12-Trihydroxycholan-24-oic Acid

Número CAS

105227-32-5

Fórmula molecular

C24H40O5

Peso molecular

408.57

Masa exacta

408.29

SMILES

O[C@H]1[C@]2([C@]3([C@@](C)([C@@]([C@@H](CCC(O)=O)C)(CC3)[H])[C@H](O)C[C@@]2([C@]4(C)[C@@](C1)(C[C@H](O)CC4)[H])[H])[H])[H]

InChI

InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1

IUPAC

(R)-4-((3R,5R,7R,8R,9S,10S,12R,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat