4-[(E)-4-methyl-8-oxidanyl-oct-1-enyl]-6a-oxidanyl-1,3,3a,4,5,6-hexahydropentalen-2-one

Systemtic Name: 4-[(E)-4-methyl-8-oxidanyl-oct-1-enyl]-6a-oxidanyl-1,3,3a,4,5,6-hexahydropentalen-2-one Openeye Name: 6a-hydroxy-4-[(E)-8-hydroxy-4-methyl-oct-1-enyl]-1,3,3a,4,5,6-hexahydropentalen-2-one CAS Name: 6a-hydroxy-4-[(E)-8-hydroxy-4-methyloct-1-enyl]-1,3,3a,4,5,6-hexahydropentalen-2-one IUPAC Name: 6a-hydroxy-4-[(E)-8-hydroxy-4-methyloct-1-enyl]-1,3,3a,4,5,6-hexahydropentalen-2-one Traditional Name: 6a-hydroxy-4-[(E)-8-hydroxy-4-methyl-oct-1-enyl]-1,3,3a,4,5,6-hexahydropentalen-2-one Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCO)CC=CC1CCC2(C1CC(=O)C2)O

Isomeric SMILES

CC(CCCCO)C/C=C/C1CCC2(C1CC(=O)C2)O

InChI

InChI=1S/C17H28O3/c1-13(5-2-3-10-18)6-4-7-14-8-9-17(20)12-15(19)11-16(14)17/h4,7,13-14,16,18,20H,2-3,5-6,8-12H2,1H3/b7-4+