Produkty 129099-70-3
CAS 129099-70-3 to numer rejestracyjny substancji 3β,4β,7α,12α-THBA. Oferty producentów: MedChemExpress, Sigma-Aldrich. Dostępne opakowania: Get quote, 1MG.
(4R)-4-[(3S,4R,5S,7R,8R,9S,10R,12S,13R,14S,17R)-3,4,7,12-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid (CAS 129099-70-3) to związek chemiczny o wzorze sumarycznym C24H40O6 i masie molowej 424.6 g/mol. Nazwa systematyczna IUPAC: (4R)-4-[(3S,4R,5S,7R,8R,9S,10R,12S,13R,14S,17R)-3,4,7,12-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid. InChIKey: WGGZRKVUOFMQHM-VCELIZGUSA-N.
| Wzór sumaryczny | C24H40O6 |
|---|---|
| Masa molowa | 424.6 g/mol |
| Nazwa IUPAC | (4R)-4-[(3S,4R,5S,7R,8R,9S,10R,12S,13R,14S,17R)-3,4,7,12-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
| InChIKey | WGGZRKVUOFMQHM-VCELIZGUSA-N |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@@H]([C@@H]4O)O)C)O)O)C |
Dane obliczone przez PubChem (NCBI)
Synonimy:
3beta,4beta,7alpha,12alpha-Tetrahydroxy-5beta-cholan-24-oic Acid, 3b,4b,7a,12a-Tetrahydroxy-5b-cholanoic acid, orb3144600, 3b,4b,7a,12a-Tetrahydroxy-5b-cholanoate, 3b,4b,7a,12a-Tetrahydroxy-5b-cholan-24-oic acid, 3beta,4beta,7alpha,12alpha-Tetrahydroxy-5beta-cholanoic acid, 3I(2),4I(2),7I+/-,12I+/--Tetrahydroxy-5I(2)-cholan-24-oic acid