Products 54334-04-2

CAS 54334-04-2 appears in our catalog under these names: 4β–Hydroxywithanolide E, 4beta-Hydroxywithanolide E, 4β-Hydroxywithanolide E. Offered by: GLPBio, TargetMol, MedChemExpress. Available pack sizes: 1mg, 1 mg.

4β–Hydroxywithanolide E
GLPBio
  • size: 1mg
  • Variants: 1
from 2993.46
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4beta-Hydroxywithanolide E
TargetMol
  • size: 1mg
  • Variants: 1
from 12186.64
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4β-Hydroxywithanolide E
MedChemExpress
  • size: 1 mg
  • Variants: 1
from 3380.09
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Structural formula: {0} (CAS {1})

4beta-Hydroxywithanolide E is a withanolide.

Source: ChEBI

Identity
Molecular formulaC28H38O8
Molecular weight502.6 g/mol
IUPAC name(1S,2R,6S,7R,9R,11R,12R,15S,16S)-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-6,12,15-trihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
InChIKeyUPBUGICUKQIKTJ-KABTZXSUSA-N
SMILESCC1=C(C(=O)O[C@H](C1)[C@@](C)([C@@]2(CC[C@@]3([C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@@H]6O)C)O5)C)O)O)O)C

Computed by PubChem (NCBI)

Synonyms: 4beta-Hydroxywithanolide E, 4|A-Hydroxywithanolide E, 4-beta-Hydroxywithanolide E, 4beta-hydroxywithanolide, Withanolide E, 4-beta-hydroxy-, 4|?-Hydroxywithanolide E, 4I(2)-Hydroxywithanolide E, 4.beta.-Hydroxywithanolide E, orb1683481, 4beta-Hydroxywithanolide E, NSC 212509
Isomers (same molecular formula)
(1R,2S,3S,5S,6R,8S,9R,12S,13R,18R,19R)-6-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-3,8,18,19-tetrahydroxy-6,13-dimethyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-15-en-14-one C28H38O8
[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate C28H38O8