Products 927822-17-1
CAS 927822-17-1 appears in our catalog under these names: Precalciferol (Previtamin D3) Related Compound 1, Pre-Vitamin D3 Octanoate (>80%). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 0,5mg, 2,5mg, 5mg.
[(1S)-3-[(Z)-2-[(1R,3aR,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-yl] octanoate (CAS 927822-17-1) is a chemical compound with the molecular formula C35H58O2 and a molecular weight of 510.8 g/mol. IUPAC name: [(1S)-3-[(Z)-2-[(1R,3aR,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-yl] octanoate. InChIKey: XTHWNUBVLBHLCC-DHMNTGMSSA-N.
| Molecular formula | C35H58O2 |
|---|---|
| Molecular weight | 510.8 g/mol |
| IUPAC name | [(1S)-3-[(Z)-2-[(1R,3aR,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-yl] octanoate |
| InChIKey | XTHWNUBVLBHLCC-DHMNTGMSSA-N |
| SMILES | CCCCCCCC(=O)O[C@H]1CCC(=C(C1)/C=C\C2=CCC[C@]3([C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C)C |
Computed by PubChem (NCBI)