Primary Record
simplexin F
- In stock
- 9,166 g
- Purity
- 98.4 %
- CAS
- 1154411-24-1
Compound Identifiers & Properties
- CAS
- 1154411-24-1
- PubChem CID
- 44179334
- SMILES
- CCCC(=O)O[C@@]1(CC[C@@H]([C@@](C[C@@H]2[C@@H]3[C@H]([C@H]1O2)[C@H]([C@@H]([C@H]([C@@]3(C)O)OC(=O)C)O)C(C)C)(C)O)OC(=O)C)C
- Canonical SMILES
- CCCC(=O)O[C@]1(C)CC[C@H](OC(C)=O)[C@@](C)(O)C[C@H]2O[C@@H]1[C@@H]1[C@@H](C(C)C)[C@H](O)[C@@H](OC(C)=O)[C@@](C)(O)[C@@H]12
Names & Synonyms
- simplexin F
- RefChem:183101
- CHEMBL540422
- J2.744.882H
- ((1R,2S,3S,4R,5S,6R,7R,8R,9R,12S,13S)-4,12-diacetyloxy-3,5,13-trihydroxy-3,9,13-trimethyl-6-propan-2-yl-15-oxatricyclo(6.6.1.02,7)pentadecan-9-yl) butanoate
- (1R,2R,3R,6S,7S,9R,10S,11S,12R,13S,14R)-2,9-Epoxy-3-(butanoyloxy)-3,7,11-trimethyl-6,12-diacetoxy-14-isopropylbicyclo[8.4.0]tetradecane-7,11,13-triol
- (1R,2S,3S,4R,5S,6R,7R,8R,9R,12S,13S)-4,12-bis(acetyloxy)-3,5,13-trihydroxy-3,9,13-trimethyl-6-(propan-2-yl)-15-oxatricyclo[6.6.1.02,7]pentadecan-9-yl butanoate
- [(1R,2S,3S,4R,5S,6R,7R,8R,9R,12S,13S)-4,12-diacetyloxy-3,5,13-trihydroxy-3,9,13-trimethyl-6-propan-2-yl-15-oxatricyclo[6.6.1.02,7]pentadecan-9-yl] butanoate
- 1154411-24-1