(3aS,4S,5R,6aS)-2-methylidene-4-(3-methyl-3-oxidanyl-nonyl)-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one

Systemtic Name: (3aS,4S,5R,6aS)-2-methylidene-4-(3-methyl-3-oxidanyl-nonyl)-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one Openeye Name: (3aS,4S,5R,6aS)-5-hydroxy-4-(3-hydroxy-3-methyl-nonyl)-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one CAS Name: (3aS,4S,5R,6aS)-5-hydroxy-4-(3-hydroxy-3-methylnonyl)-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one IUPAC Name: (3aS,4S,5R,6aS)-5-hydroxy-4-(3-hydroxy-3-methylnonyl)-2-methylidene-3,3a,4,5,6,6a-hexahydropentalen-1-one Traditional Name: (3aS,4S,5R,6aS)-5-hydroxy-4-(3-hydroxy-3-methyl-nonyl)-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one Formula: C19H32O3 MolecularWeight: 308.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(CCC1C(CC2C1CC(=C)C2=O)O)O

Isomeric SMILES

CCCCCCC(C)(CC[C@@H]1[C@@H](C[C@H]2[C@H]1CC(=C)C2=O)O)O

InChI

InChI=1S/C19H32O3/c1-4-5-6-7-9-19(3,22)10-8-14-15-11-13(2)18(21)16(15)12-17(14)20/h14-17,20,22H,2,4-12H2,1,3H3/t14-,15-,16-,17+,19?/m0/s1