CAS 751-03-1 appears in our catalog under these names: Obacunone, Obacunone/ 99.49% (existing batch purity), Obacunone, >98.0%(HPLC), Obacunone 98%, (1S,3aS,4aR,4bR,6aR,11aR,11bR,13aS)-1-(furan-3-yl)-4b,7,7,11a,13a-pentamethyl-1,6a,7,11a,11b,12,13,13a-octahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromene-3,5,9(3aH,4bH,6H)-trione, 98%, 98%. Offered by: Chemat Brand, GLPBio, TargetMol, TCI, Ambeed. Available pack sizes: on request, 20mg, 5mg, 10mg, 25mg, 50mg, 100mg, 1mg.
Obacunone is a limonoid.
Source: ChEBI
| Molecular formula | C26H30O7 |
|---|---|
| Molecular weight | 454.5 g/mol |
| IUPAC name | (1R,2R,4S,7S,8S,11R,12R,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15,20-trione |
| InChIKey | MAYJEFRPIKEYBL-OASIGRBWSA-N |
| SMILES | C[C@@]12CC[C@@H]3[C@]4(C=CC(=O)OC([C@@H]4CC(=O)[C@]3([C@@]15[C@H](O5)C(=O)O[C@H]2C6=COC=C6)C)(C)C)C |
Computed by PubChem (NCBI)