Products 26989-18-4
CAS 26989-18-4 is the registry number for Petiline. Offered by: MedChemExpress. Available pack sizes: Get quote.
(3S,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one (CAS 26989-18-4) is a chemical compound with the molecular formula C27H43NO2 and a molecular weight of 413.6 g/mol. IUPAC name: (3S,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one. InChIKey: QAGPPGDCPAPQLW-HAQROMNMSA-N.
| Molecular formula | C27H43NO2 |
|---|---|
| Molecular weight | 413.6 g/mol |
| IUPAC name | (3S,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one |
| InChIKey | QAGPPGDCPAPQLW-HAQROMNMSA-N |
| SMILES | C[C@H]1CCC(=NC1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC(=O)[C@@H]5[C@@]4(CC[C@@H](C5)O)C)C |
Computed by PubChem (NCBI)
Synonyms:
Petiline, orb3141916