(E)-7-[3,5-bis(oxidanyl)-2-(3-oxidanylidenedecyl)cyclopentyl]hept-5-enoate

Systemtic Name: (E)-7-[3,5-bis(oxidanyl)-2-(3-oxidanylidenedecyl)cyclopentyl]hept-5-enoate Openeye Name: (E)-7-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]hept-5-enoate CAS Name: (E)-7-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]-5-heptenoate IUPAC Name: (E)-7-[3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[3,5-dihydroxy-2-(3-ketodecyl)cyclopentyl]hept-5-enoate Formula: C22H37O5- MolecularWeight: 381.52618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CCC1C(CC(C1CC=CCCCC(=O)[O-])O)O

Isomeric SMILES

CCCCCCCC(=O)CCC1C(CC(C1C/C=C/CCCC(=O)[O-])O)O

InChI

InChI=1S/C22H38O5/c1-2-3-4-5-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-7-10-13-22(26)27/h6,9,18-21,24-25H,2-5,7-8,10-16H2,1H3,(H,26,27)/p-1/b9-6+