Products 114717-13-4

CAS 114717-13-4 is the registry number for (3beta,23E)-Stigmasta-5,23-dien-3-ol 3-Acetate. Offered by: TRC. Available pack sizes: 25mg.

(3beta,23E)-Stigmasta-5,23-dien-3-ol 3-Acetate
TRC
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

[(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R)-5-ethyl-6-methylhept-4-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate (CAS 114717-13-4) is a chemical compound with the molecular formula C31H50O2 and a molecular weight of 454.7 g/mol. IUPAC name: [(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R)-5-ethyl-6-methylhept-4-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate. InChIKey: WXYOEOGKDKKAGX-NRNYOMSRSA-N.

Identity
Molecular formulaC31H50O2
Molecular weight454.7 g/mol
IUPAC name[(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R)-5-ethyl-6-methylhept-4-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChIKeyWXYOEOGKDKKAGX-NRNYOMSRSA-N
SMILESCC/C(=C\C[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)C)C)C)/C(C)C

Computed by PubChem (NCBI)

Synonyms: (3?,23E)-Stigmasta-5,23-dien-3-ol 3-Acetate
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] butanoate C31H50O2
[(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate C31H50O2