Description
IUPAC Name: (3aS,5R,5aS,8S,8aS,9aR)-8-hydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
InChI: InChI=1S/C15H22O3/c1-8-6-12-10(9(2)14(17)18-12)7-15(3)11(8)4-5-13(15)16/h8,10-13,16H,2,4-7H2,1,3H3/t8-,10-,11+,12+,13+,15+/m1/s1
InChIKey: BOPADYWRUULRBD-MBICNOSFSA-N
Canonical SMILES: CC1CC2C(CC3(C1CCC3O)C)C(=C)C(=O)O2
Isomeric SMILES: C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1CC[C@@H]3O)C)C(=C)C(=O)O2
Synonyms: 2-Desoxy-4-epi-pulchellin; 122872-03-1; PSEUDOGUAIANOLIDE; (3aS,5R,5aS,8S,8aS,9aR)-8-hydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one; (3AR,4aS,5S,7aS,8R,9aS)-5-hydroxy-4a,8-dimethyl-3-methylenedecahydroazuleno[6,5-b]furan-2(3H)-one; 2,6-Dideacetoxybritanin; 2-Deoxy-4-epipulchellin; CHEMBL1165514; HY-N1725; …
Botanical Source: