Products 927822-18-2

CAS 927822-18-2 appears in our catalog under these names: Precalciferol (Previtamin D3) Related Compound 2, Pre-Vitamin D3 Decanoate (>80%), Pre-vitamin D3 decanoate. Offered by: Chemat Brand, TRC, MedChemExpress. Available pack sizes: on request, 0,5mg, 2,5mg, 5mg, 5 mg, 500 μg, 2.5 mg, 1 mg.

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] decanoate (CAS 927822-18-2) is a chemical compound with the molecular formula C37H62O2 and a molecular weight of 538.9 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] decanoate. InChIKey: SHPULLBPHHLKCG-BUJACLEBSA-N.

Identity
Molecular formulaC37H62O2
Molecular weight538.9 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] decanoate
InChIKeySHPULLBPHHLKCG-BUJACLEBSA-N
SMILESCCCCCCCCCC(=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)