Produkty 6879-45-4
CAS 6879-45-4 to numer rejestracyjny substancji α-Phocaecholic acid. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
(2R,4R)-2-hydroxy-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 6879-45-4) to związek chemiczny o wzorze sumarycznym C24H40O6 i masie molowej 424.6 g/mol. Nazwa systematyczna IUPAC: (2R,4R)-2-hydroxy-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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: UJYLRDMHTJWIQW-SWSYAYITSA-N.
| Wzór sumaryczny | C24H40O6 |
|---|---|
| Masa molowa | 424.6 g/mol |
| Nazwa IUPAC | (2R,4R)-2-hydroxy-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 | UJYLRDMHTJWIQW-SWSYAYITSA-N |
| SMILES | C[C@H](C[C@H](C(=O)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](C4)O)C)O)O)C |
Dane obliczone przez PubChem (NCBI)
Synonimy:
3,7,12,23-Tetrahydroxycholan-24-oic acid, Cholan-24-oic acid, 3,7,12,23-tetrahydroxy-, (3alpha,5beta,7alpha,12alpha,23R)-, (3alpha,5beta,7alpha,12alpha,23R)-3,7,12,23-tetrahydroxycholan-24-oic acid, alpha-Phocaecholic acid, (23R)-3alpha,7alpha,12alpha,23-Tetrahydroxy-5beta-cholan-24-oic Acid, orb3179684, 3alpha,7alpha,12alpha,23-Tetrahydroxy-5beta-cholan-24-oic acid, 3alpha,7alpha,12alpha,23R-Tetrahydroxycholanic acid