7-[(1R,2Z,5R)-2-(4,4-dimethyl-3-oxidanyl-octylidene)-5-oxidanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1R,2Z,5R)-2-(4,4-dimethyl-3-oxidanyl-octylidene)-5-oxidanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-4,4-dimethyl-octylidene)cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-4,4-dimethyloctylidene)cyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-4,4-dimethyloctylidene)cyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-4,4-dimethyl-octylidene)cyclopentyl]enanthic acid Formula: C22H40O4 MolecularWeight: 368.5506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CC=C1CCC(C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CCCCC(C)(C)C(C/C=C\1/CC[C@H]([C@@H]1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C22H40O4/c1-4-5-16-22(2,3)20(24)15-13-17-12-14-19(23)18(17)10-8-6-7-9-11-21(25)26/h13,18-20,23-24H,4-12,14-16H2,1-3H3,(H,25,26)/b17-13-/t18-,19-,20?/m1/s1