18:1 Chol (d7) Ester

cas: 1416275-35-8 — see every product listed under this CAS number, including other names

18:1 Chol (d7) Ester (CAS 1416275-35-8) is a chemical reagent available from Chemat. Available pack sizes: 50mg, 1MG. Offered by: TRC, Sigma-Aldrich.

brandTRC
catalog numberTRC-C432516-50MG
cas1416275-35-8
size50mg
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TRC 50mg price on request
Sigma-Aldrich 1MG 943.00 Pln

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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)

Synonyms: Cholesteryl oleate-d7, cholest-5-en-3beta-yl(d7) (9Z-octadecenoate), Cholesteryl oleate-d7 Solution in Methanol, 100ug/mL, Cholest-5-en-25,26,26,26,27,27,27-d7-3-ol, 3-(9Z)-9-octadecenoate, (3I(2))-
Related forms of this compound
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-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 C45H78O2
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-octadec-9-enoate C45H78O2
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-16,16,17,17,18,18,18-heptadeuteriooctadec-9-enoate C45H78O2
Isomers (same molecular formula)
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-11-enoate C45H78O2
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-octadec-11-enoate C45H78O2

Also listed as

Cholesteryl oleate-d7, 99.0% MedChemExpress CAS 1416275-35-8