Chemical Compound

4-Dehydrowithaferin A

CAS Registry Number 6850-30-2
4-Dehydrowithaferin A chemical structure
Primary Record

4-Dehydrowithaferin A

In stock
5,426 g
Purity
98.8 %
CAS
6850-30-2

Compound Identifiers & Properties

CAS
6850-30-2
PubChem CID
165541
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=CC6=O)C)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@]56C(=O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1

Names & Synonyms

  • 4-Dehydrowithaferin A
  • 4-oxo Withaferin A
  • AC1L4WTX
  • RefChem:921100
  • 4-DWA
  • 6850-30-2
  • orb1693353
  • CHEMBL2047415
  • DTXSID00988157
  • XGPALHIQWWGRFB-TTWUVOALSA-N
  • KST-1A8285
  • C28H36O6
  • AR-1A6694
  • CID165541
  • AKOS040755506
  • PD069615
  • 4-oxo Withaferin A, 4-Dehydrowithaferin A
  • HY-138146
  • CS-0145500
  • (1S,2R,7S,9R,11S,12S,15R,16S)-15-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-ene-3,6-dione
  • (5|A,6|A,22r)-27-hydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,4,26-trione
  • 27-Hydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,4,26-trione
  • (4aS,5aR,6aS,6bS,9R,9aS,11aS,11bR)-9-((S)-1-((R)-5-(hydroxymethyl)-4-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl)-9a,11b-dimethyl-5a,6,6a,6b,7,8,9,9a,10,11,11a,11b-dodecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxirene-1,4-dione
  • 79869-74-2
  • Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-22,27-dihydroxy-1,4-dioxo-, delta-lactone, (5beta,6beta,22R)-
  • (22R)-27-Hydroxy-5beta,6beta-5,6:22,26-diepoxyergosta-2,24-diene-1,4,26-trione
  • (1S,2R,7S,9R,11S,12S,15R,16S)-15-((1S)-1-((2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl)-2,16-dimethyl-8-oxapentacyclo(9.7.0.02,7.07,9.012,16)octadec-4-ene-3,6-dione
  • N/A