Products 1214886-27-7
CAS 1214886-27-7 is the registry number for 4-epi-Withaferin A. Offered by: MedChemExpress. Available pack sizes: Get quote.
(1S,2R,6R,7R,9R,11S,12S,15R,16S)-6-hydroxy-15-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one (CAS 1214886-27-7) is a chemical compound with the molecular formula C28H38O6 and a molecular weight of 470.6 g/mol. IUPAC name: (1S,2R,6R,7R,9R,11S,12S,15R,16S)-6-hydroxy-15-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one. InChIKey: DBRXOUCRJQVYJQ-SKXGSRCNSA-N.
| Molecular formula | C28H38O6 |
|---|---|
| Molecular weight | 470.6 g/mol |
| IUPAC name | (1S,2R,6R,7R,9R,11S,12S,15R,16S)-6-hydroxy-15-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one |
| InChIKey | DBRXOUCRJQVYJQ-SKXGSRCNSA-N |
| SMILES | CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@H]6O)C)O5)C)CO |
Computed by PubChem (NCBI)
Synonyms:
4-epi-Withaferin A, orb1941452