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

Systemtic Name: 2-[(1R,2R,3R)-3-methyl-2-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 2-[(1R,2R,3R)-2-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-3-methyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 2-[(1R,2R,3R)-2-[(E)-3-hydroxy-3-methyloct-1-enyl]-3-methyl-5-oxocyclopentyl]heptanoic acid IUPAC Name: 2-[(1R,2R,3R)-2-[(E)-3-hydroxy-3-methyloct-1-enyl]-3-methyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 2-[(1R,2R,3R)-2-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-5-keto-3-methyl-cyclopentyl]enanthic acid Formula: C22H38O4 MolecularWeight: 366.53472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1C(C(CC1=O)C)C=CC(C)(CCCCC)O)C(=O)O

Isomeric SMILES

CCCCCC([C@H]1[C@H]([C@@H](CC1=O)C)/C=C/C(C)(CCCCC)O)C(=O)O

InChI

InChI=1S/C22H38O4/c1-5-7-9-11-18(21(24)25)20-17(16(3)15-19(20)23)12-14-22(4,26)13-10-8-6-2/h12,14,16-18,20,26H,5-11,13,15H2,1-4H3,(H,24,25)/b14-12+/t16-,17+,18?,20-,22?/m1/s1