Chemical Compound

Withalongolide A

CAS Registry Number 1350448-42-8
Withalongolide A chemical structure
Primary Record

Withalongolide A

In stock
4,419 g
Purity
98.9 %
CAS
1350448-42-8

Compound Identifiers & Properties

CAS
1350448-42-8
PubChem CID
56649343
SMILES
CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@@H]6O)CO)O5)C)CO
Canonical SMILES
CC1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(CO)[C@H]4CC[C@]23C)C1

Names & Synonyms

  • Withalongolide A
  • 19-hydroxywithaferin A
  • RefChem:194905
  • 19-hydroxy-Withaferin A
  • CHEBI:69106
  • CHEMBL1934449
  • SCHEMBL30475075
  • DTXSID701316661
  • J3.017.641C
  • Q27137447
  • 1350448-42-8
  • (4beta,5beta,6beta,22R)-4,19,27-trihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione
  • (1S,2S,6S,7R,9R,11S,12S,15R,16S)-6-hydroxy-2-(hydroxymethyl)-15-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl]-16-methyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
  • (22R)-1-Oxo-4beta,19,22,27-tetrahydroxy-5beta,6beta-epoxyergosta-2,24-diene-26-oic acid delta-lactone
  • (22R)-4beta,19,27-Trihydroxy-5beta,6beta-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione