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

Systemtic Name: (E)-7-[3,5-bis(oxidanyl)-2-(3-oxidanylidenenonyl)cyclopentyl]hept-5-enoate Openeye Name: (E)-7-[3,5-dihydroxy-2-(3-oxononyl)cyclopentyl]hept-5-enoate CAS Name: (E)-7-[3,5-dihydroxy-2-(3-oxononyl)cyclopentyl]-5-heptenoate IUPAC Name: (E)-7-[3,5-dihydroxy-2-(3-oxononyl)cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[3,5-dihydroxy-2-(3-ketononyl)cyclopentyl]hept-5-enoate Formula: C21H35O5- MolecularWeight: 367.4996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H36O5/c1-2-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26/h5,8,17-20,23-24H,2-4,6-7,9-15H2,1H3,(H,25,26)/p-1/b8-5+