Products 156767-69-0

CAS 156767-69-0 appears in our catalog under these names: (24S)-3beta-Hydroxyergost-5-en-7-one, (3β)-3-Hydroxyergost-5-en-7-one. Offered by: TRC, MedChemExpress. Available pack sizes: 50mg, Get quote.

(24S)-3beta-Hydroxyergost-5-en-7-one
TRC
  • size: 50mg
  • Variants: 1
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(3β)-3-Hydroxyergost-5-en-7-one
MedChemExpress
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Structural formula: {0} (CAS {1})

(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one (CAS 156767-69-0) is a chemical compound with the molecular formula C28H46O2 and a molecular weight of 414.7 g/mol. IUPAC name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one. InChIKey: LTLKHSBYMNKWPF-WSDDEMAPSA-N.

Identity
Molecular formulaC28H46O2
Molecular weight414.7 g/mol
IUPAC name(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
InChIKeyLTLKHSBYMNKWPF-WSDDEMAPSA-N
SMILESC[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)C

Computed by PubChem (NCBI)

Synonyms: 3beta-Hydroxyergost-5-en-7-one, 3-beta-Hydroxyergost-5-en-7-one, Ergost-5-en-7-one, 3-hydroxy-, (3beta)-, (24S)-3beta-Hydroxyergost-5-en-7-one, orb1991117
Isomers (same molecular formula)
(3S,10R,12R,13R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol C28H46O2
trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5S)-5,6-dimethylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol C28H46O2