Vitamin D3 octanoate (Standard)

cas: 927822-16-0 — see every product listed under this CAS number, including other names

Vitamin D3 octanoate (Standard) (CAS 927822-16-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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Structural formula: {0} (CAS {1})

[(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] octanoate (CAS 927822-16-0) is a chemical compound with the molecular formula C35H58O2 and a molecular weight of 510.8 g/mol. IUPAC name: [(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] octanoate. InChIKey: ARPKBLFKZDOQKT-MOKSJEDKSA-N.

Identity
Molecular formulaC35H58O2
Molecular weight510.8 g/mol
IUPAC name[(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexyl] octanoate
InChIKeyARPKBLFKZDOQKT-MOKSJEDKSA-N
SMILESCCCCCCCC(=O)O[C@H]1CCC(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C)/C1

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