Pre-Vitamin D3 Octanoate (>80%)

cas: 927822-17-1 — see every product listed under this CAS number, including other names

Pre-Vitamin D3 Octanoate (>80%) (CAS 927822-17-1) is a chemical reagent available from Chemat. Available pack sizes: 0,5mg, 2,5mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-P822170-0.5MG
cas927822-17-1
size0,5mg
Need more information?

Ask us about this product — we're happy to help.

Available pack sizes

brand size price
TRC 0,5mg price on request
TRC 2,5mg price on request
TRC 5mg price on request

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

[(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.

Identity
Molecular formulaC35H58O2
Molecular weight510.8 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
InChIKeyXTHWNUBVLBHLCC-DHMNTGMSSA-N
SMILESCCCCCCCC(=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)

Synonyms: Pre-Vitamin D3 Octanoate (>80%), Pre-Vitamin D3 Octanoate, Previtamin D3 Impurity 89
Isomers (same molecular formula)
[(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 C35H58O2

Also listed as

Precalciferol (Previtamin D3) Related Compound 1 Chemat Brand CAS 927822-17-1