(4aS,9S,9aR)-9-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-5-prop-2-enyl-2,3,4,4a,9,9a-hexahydroxanthen-1-one

Systemtic Name: (4aS,9S,9aR)-9-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-5-prop-2-enyl-2,3,4,4a,9,9a-hexahydroxanthen-1-one Openeye Name: (4aS,9S,9aR)-5-allyl-9-(2-hydroxy-6-oxo-cyclohexen-1-yl)-2,3,4,4a,9,9a-hexahydroxanthen-1-one CAS Name: (4aS,9S,9aR)-9-(2-hydroxy-6-oxo-1-cyclohexenyl)-5-prop-2-enyl-2,3,4,4a,9,9a-hexahydroxanthen-1-one IUPAC Name: (4aS,9S,9aR)-9-(2-hydroxy-6-oxocyclohexen-1-yl)-5-prop-2-enyl-2,3,4,4a,9,9a-hexahydroxanthen-1-one Traditional Name: (4aS,9S,9aR)-5-allyl-9-(2-hydroxy-6-keto-cyclohexen-1-yl)-2,3,4,4a,9,9a-hexahydroxanthen-1-one Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC3CCCC(=O)C3C2C4=C(CCCC4=O)O

Isomeric SMILES

C=CCC1=CC=CC2=C1O[C@H]3CCCC(=O)[C@@H]3[C@@H]2C4=C(CCCC4=O)O

InChI

InChI=1S/C22H24O4/c1-2-6-13-7-3-8-14-19(20-15(23)9-4-10-16(20)24)21-17(25)11-5-12-18(21)26-22(13)14/h2-3,7-8,18-19,21,23H,1,4-6,9-12H2/t18-,19-,21-/m0/s1