Products 40824-59-7

CAS 40824-59-7 appears in our catalog under these names: (3Beta,7Alpha)-Cholest-5-ene-3,7-diol 3-Benzoate, (3b,7a)-Cholest-5-ene-3,7-diol 3-benzoate. Offered by: TRC, Biosynth. Available pack sizes: 1mg, 2mg, 5mg, 10mg.

(3Beta,7Alpha)-Cholest-5-ene-3,7-diol 3-Benzoate
TRC
  • size: 1mg, 2mg, 5mg
  • Variants: 3
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(3b,7a)-Cholest-5-ene-3,7-diol 3-benzoate
Biosynth
  • size: 2mg, 1mg, 5mg, 10mg
  • Variants: 4
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Structural formula: {0} (CAS {1})

[(3S,7S,8S,9S,10R,13R,14S)-7-hydroxy-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] benzoate (CAS 40824-59-7) is a chemical compound with the molecular formula C34H50O3 and a molecular weight of 506.8 g/mol. IUPAC name: [(3S,7S,8S,9S,10R,13R,14S)-7-hydroxy-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] benzoate. InChIKey: YAQOZGBTTMUPRW-SPKZKWMQSA-N.

Identity
Molecular formulaC34H50O3
Molecular weight506.8 g/mol
IUPAC name[(3S,7S,8S,9S,10R,13R,14S)-7-hydroxy-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] benzoate
InChIKeyYAQOZGBTTMUPRW-SPKZKWMQSA-N
SMILESC[C@H](CCCC(C)C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C=C4[C@@]3(CC[C@@H](C4)OC(=O)C5=CC=CC=C5)C)O)C

Computed by PubChem (NCBI)

Synonyms: (3beta,7alpha)-Cholest-5-ene-3,7-diol 3-Benzoate, 7a-Hydroxycholesterol 3b-benzoate, Cholest-5-ene-3b,7a-diol 3-benzoate, (3?,7?)-Cholest-5-ene-3,7-diol 3-Benzoate, (17xi)-7alpha-Hydroxycholest-5-en-3beta-yl benzoate