Primary Record
Citrusin
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 101127372
- SMILES
- CC(=O)OC1CC(=O)OC([C@H]2[C@]1([C@H]3CC[C@]4([C@@H](OC(=O)[C@@H]5[C@@]4([C@@]3(C(=O)C2)C)O5)C6=C[C@H](OC6=O)O)C)C)(C)C
- Canonical SMILES
- CC(=O)OC1CC(=O)OC(C)(C)[C@@H]2CC(=O)[C@]3(C)[C@H](CC[C@@]4(C)[C@H](C5=C[C@@H](O)OC5=O)OC(=O)[C@H]5O[C@]543)[C@@]12C
Names & Synonyms
- Citrusin
- SCHEMBL29572957
- J1.595.633J
- (23S)-1alpha-Acetoxy-1,2,21,23-tetrahydro-23-hydroxy-21-oxoobacunoic acid epsilon-lactone
- (1R,2R,4S,7R,8S,11R,12R,18R)-7-[(5S)-5-hydroxy-2-oxo-2,5-dihydrofuran-3-yl]-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl acetate