| 2D Structure | |
| CID | 100572 |
| Target | / |
| IUPAC Name | (3aS,6aR,9aR,9bS)-6-methyl-3,9-dimethylidene-4,6a,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one |
| InChI | InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h4,11-14H,2-3,5-7H2,1H3/t11-,12-,13-,14-/m0/s1 |
| InChI Key | BWRZDLYJNURUHS-XUXIUFHCSA-N |
| Canonical SMILES | CC1=CCC2C(C3C1CCC3=C)OC(=O)C2=C |
| Isomeric SMILES | CC1=CC[C@@H]2[C@@H]([C@@H]3[C@H]1CCC3=C)OC(=O)C2=C |
| Molecular Formula | C15H18O2 |
| Molecular Weight | 230.30 |
| synonyms | ['Eremanthin', '37936-58-6', 'Vanillosmin', 'CHEBI:4815', '(3aS,6aR,9aR,9bS)-6-methyl-3,9-dimethylidene-4,6a,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2-one', 'NSC321215', 'NSC 321215', 'CHEMBL451364', 'SCHEMBL9516039', 'DTXSID50191371', 'BWRZDLYJNURUHS-XUXIUFHCSA-N', 'NSC-321215', 'NCI60_002782', 'C09406', 'Q27106489', 'Azuleno(4,5-b)furan-2(3H)-one, 3a,4,6a,7,8,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-, (3aS-(3aalpha,6aalpha,9aalpha,9bbeta))-', 'Azuleno[4, 3a,4,6a,7,8,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-, [3aS-(3a.alpha.,6a.alpha.,9a.alpha.,9b.beta.)]-'] |
From Pubchem