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

Systemtic Name: 7-[(1R,2Z,5R)-2-(3,4-dimethyl-3-oxidanyl-octylidene)-5-oxidanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-3,4-dimethyl-octylidene)cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-3,4-dimethyloctylidene)cyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-3,4-dimethyloctylidene)cyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2R,5Z)-2-hydroxy-5-(3-hydroxy-3,4-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/c1-4-5-10-17(2)22(3,26)16-15-18-13-14-20(23)19(18)11-8-6-7-9-12-21(24)25/h15,17,19-20,23,26H,4-14,16H2,1-3H3,(H,24,25)/b18-15-/t17?,19-,20-,22?/m1/s1