2-methyl-7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 2-methyl-7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-oxo-cyclopentyl]-2-methyl-heptanoic acid CAS Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]-2-methylheptanoic acid IUPAC Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]-2-methylheptanoic acid Traditional Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-keto-cyclopentyl]-2-methyl-enanthic acid Formula: C22H38O5 MolecularWeight: 382.53412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCC(C)C(=O)O)O)O

Isomeric SMILES

CCCCC(C)(C/C=C/C1C(CC(=O)C1CCCCCC(C)C(=O)O)O)O

InChI

InChI=1S/C22H38O5/c1-4-5-13-22(3,27)14-9-12-18-17(19(23)15-20(18)24)11-8-6-7-10-16(2)21(25)26/h9,12,16-18,20,24,27H,4-8,10-11,13-15H2,1-3H3,(H,25,26)/b12-9+