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

Systemtic Name: 2-methylidene-4-[(E)-5-methyl-4-oxidanyl-non-1-enyl]-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one Openeye Name: 5-hydroxy-4-[(E)-4-hydroxy-5-methyl-non-1-enyl]-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one CAS Name: 5-hydroxy-4-[(E)-4-hydroxy-5-methylnon-1-enyl]-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one IUPAC Name: 5-hydroxy-4-[(E)-4-hydroxy-5-methylnon-1-enyl]-2-methylidene-3,3a,4,5,6,6a-hexahydropentalen-1-one Traditional Name: 5-hydroxy-4-[(E)-4-hydroxy-5-methyl-non-1-enyl]-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one Formula: C19H30O3 MolecularWeight: 306.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(CC=CC1C(CC2C1CC(=C)C2=O)O)O

Isomeric SMILES

CCCCC(C)C(C/C=C/C1C(CC2C1CC(=C)C2=O)O)O

InChI

InChI=1S/C19H30O3/c1-4-5-7-12(2)17(20)9-6-8-14-15-10-13(3)19(22)16(15)11-18(14)21/h6,8,12,14-18,20-21H,3-5,7,9-11H2,1-2H3/b8-6+