Products 1416275-35-8

CAS 1416275-35-8 appears in our catalog under these names: 18:1 Chol (d7) Ester, Cholesteryl oleate-d7, 99.0%. Offered by: TRC, Sigma-Aldrich, MedChemExpress. Available pack sizes: 50mg, 1MG, 1 mg (1.52 mM * 1 mL in Methylene chloride).

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

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate (CAS 1416275-35-8) is a chemical compound with the molecular formula C45H78O2 and a molecular weight of 658.1 g/mol. IUPAC name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate. InChIKey: RJECHNNFRHZQKU-IHPCOYDHSA-N.

Identity
Molecular formulaC45H78O2
Molecular weight658.1 g/mol
IUPAC name[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate
InChIKeyRJECHNNFRHZQKU-IHPCOYDHSA-N
SMILES[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCCCCCC/C=C\CCCCCCCC)C)C)C([2H])([2H])[2H]

Computed by PubChem (NCBI)