Primary Record
withanone
- In stock
- 7,629 g
- Purity
- 99.5 %
- CAS
- 27570-38-3
Compound Identifiers & Properties
- CAS
- 27570-38-3
- PubChem CID
- 21679027
- SMILES
- CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@]2(CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3[C@H]5[C@H](O5)[C@@]6([C@@]4(C(=O)C=CC6)C)O)C)O)C
- Canonical SMILES
- CC1=C(C)C(=O)O[C@@H]([C@@H](C)[C@@]2(O)CC[C@H]3[C@@H]4[C@@H]5O[C@@H]5[C@@]5(O)CC=CC(=O)[C@]5(C)[C@H]4CC[C@@]32C)C1
Names & Synonyms
- withanone
- Withanone(sh)
- 27570-38-3
- Withanone (Standard)
- RefChem:194922
- UNII-GY036XA633
- GY036XA633
- NSC-179884
- Withanone, analytical standard
- DTXSID40950237
- CHEMBL516703
- orb1681461
- SCHEMBL2234025
- GTPL13098
- CHEBI:231685
- MFCD09264639
- DTXCID801776042
- C28H38O6
- CBA57038
- BDBM50599324
- EX-A11175
- ZINC42876996
- (22R)-5a,17a-Dihydroxy-6a,7a
- AKOS040762509
- HY-129692R
- (22R)-5alpha,17alpha-Dihydroxy-6alpha,7alpha
- compound 11 [PMID: 30776236]
- 6,7-epoxy-5,17-dihydroxy-1-oxowitha-2,24-dienolide
- CID:21679027
- DA-68707
- J17.350I
- MS-28706
- Withanone (constituent of ashwagandha root) [DSC]
- SID:350085985
- HY-129692
- (22R)-5|A,17|A-Dihydroxy-6|A,7|A
- CS-0107490
- (1S,2S,4S,5R,10R,11S,14S,15S,18S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadec-7-en-9-one
- C560597
- WITHANONE (CONSTITUENT OF ASHWAGANDHA ROOT)
- A1024776
- Q27279346
- (5alpha,6alpha,7alpha,22R)-5,17-Dihydroxy-6,7:22,26-diepoxyergosta-2,24-diene-1,26-dione
- (22R)-5,17-Dihydroxy-6,7:22,26-diepoxyergosta-2,24-diene-1,26-dione
- (1S,2S,4S,5R,10R,11S,14S,15S,18S)-15-((1R)-1-((2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl)-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo(9.7.0.02,4.05,10.014,18)octadec-7-en-9-one
- (1S,2S,4S,5R,10R,11S,14S,15S,18S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadec-7-en-9-one
- (20R)-6alpha,7alpha-Epoxy-5,17-dihydroxy-20-[(R)-2,3-dihydro-4,5-dimethyl-6-oxo-6H-pyran-2-yl]-5alpha-pregna-2-ene-1-one
- (22R)-5,17-Dihydroxy-5alpha,6alpha,7alpha-6,7:22,26-diepoxyergosta-2,24-diene-1,26-dione
- (22R)-6|A,7|A-Epoxy-5,17,22-trihydroxy-1-oxo-5|A-ergosta-2,24-dien-26-oic acid |A-lactone
- (22R)-6alpha,7alpha-Epoxy-5,17,22-trihydroxy-1-oxo-5alpha-ergosta-2,24-dien-26-oic acid delta-lactone
- (22R)-delta-Lactone 6alpha,7alpha-epoxy-5,17,22-trihydroxy-1-oxo-5alpha-ergosta-2,24-dien-26-oic Acid
- (4aR,4bS,6aS,7S,9aS,9bS,9cS,10aS,10bR)-7-((R)-1-((R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl)-7,10b-dihydroxy-4a,6a-dimethyl-4b,5,6,6a,7,8,9,9a,9b,9c,10a,10b-dodecahydro-1H-cyclopenta[1,2]phenanthro[9,10-b]oxiren-4(4aH)-one
- (5.ALPHA.,6.ALPHA.,7.ALPHA.,22R)-5,17-DIHYDROXY-6,7:22,26-DIEPOXYERGOSTA-2,24-DIENE-1,26-DIONE
- (5ALPHA,6ALPHA,7ALPHA,22R)-6,7-EPOXY-5,17,22-TRIHYDROXY-1-OXOERGOSTA-2,24-DIEN-26-OIC ACID D-LACTONE
- 15-[1-(4,5-Dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadec-7-en-9-one