[3-(7-methoxy-7-oxidanylidene-heptyl)-2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanylidene-cyclopentyl] phosphate

Systemtic Name: [3-(7-methoxy-7-oxidanylidene-heptyl)-2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanylidene-cyclopentyl] phosphate Openeye Name: [2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-3-(7-methoxy-7-oxo-heptyl)-4-oxo-cyclopentyl] phosphate CAS Name: [2-[(E)-4-hydroxy-4-methyloct-1-enyl]-3-(7-methoxy-7-oxoheptyl)-4-oxocyclopentyl] phosphate IUPAC Name: [2-[(E)-4-hydroxy-4-methyloct-1-enyl]-3-(7-methoxy-7-oxoheptyl)-4-oxocyclopentyl] phosphate Traditional Name: [2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-4-keto-3-(7-keto-7-methoxy-heptyl)cyclopentyl] phosphate Formula: C22H37O8P-2 MolecularWeight: 460.498141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)OC)OP(=O)([O-])[O-])O

Isomeric SMILES

CCCCC(C)(C/C=C/C1C(CC(=O)C1CCCCCCC(=O)OC)OP(=O)([O-])[O-])O

InChI

InChI=1S/C22H39O8P/c1-4-5-14-22(2,25)15-10-12-18-17(11-8-6-7-9-13-21(24)29-3)19(23)16-20(18)30-31(26,27)28/h10,12,17-18,20,25H,4-9,11,13-16H2,1-3H3,(H2,26,27,28)/p-2/b12-10+