Products 211363-15-4
CAS 211363-15-4 is the registry number for (24R,25R)-3Alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA. Offered by: MedChemExpress. Available pack sizes: Get quote.
(24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA is a steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oic acid. It has a role as a human metabolite. It is a conjugate acid of a (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA(4-).
Source: ChEBI
| Molecular formula | C48H80N7O20P3S |
|---|---|
| Molecular weight | 1200.2 g/mol |
| IUPAC name | S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (2R,3R,6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-hydroxy-2-methylheptanethioate |
| InChIKey | SZBMUAIJWNJARR-UIZKVWQNSA-N |
| SMILES | C[C@H](CC[C@H]([C@@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)O)[C@H]4CC[C@@H]5[C@@]4(CC[C@H]6[C@H]5[C@@H](C[C@H]7[C@@]6(CC[C@H](C7)O)C)O)C |
Computed by PubChem (NCBI)
Synonyms:
(24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA, (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-coenzyme A(4-), (24R,25R)-3a,7a,24-Trihydroxy-5b-cholestan-26-oyl-CoA, (24R,25R)-3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA, (24R,25R)-3a,7a,24-Trihydroxy-5b-cholestan-26-oyl-coenzyme A(4-), (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-coenzyme A