5-oxidanyl-6-[5-[(1E,5E)-3-oxidanylundeca-1,5-dienyl]furan-2-yl]hexanoic acid

Systemtic Name: 5-oxidanyl-6-[5-[(1E,5E)-3-oxidanylundeca-1,5-dienyl]furan-2-yl]hexanoic acid Openeye Name: 5-hydroxy-6-[5-[(1E,5E)-3-hydroxyundeca-1,5-dienyl]-2-furyl]hexanoic acid CAS Name: 5-hydroxy-6-[5-[(1E,5E)-3-hydroxyundeca-1,5-dienyl]-2-furanyl]hexanoic acid IUPAC Name: 5-hydroxy-6-[5-[(1E,5E)-3-hydroxyundeca-1,5-dienyl]furan-2-yl]hexanoic acid Traditional Name: 5-hydroxy-6-[5-[(1E,5E)-3-hydroxyundeca-1,5-dienyl]-2-furyl]hexanoic acid Formula: C21H32O5 MolecularWeight: 364.47578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC(C=CC1=CC=C(O1)CC(CCCC(=O)O)O)O

Isomeric SMILES

CCCCC/C=C/CC(/C=C/C1=CC=C(O1)CC(CCCC(=O)O)O)O

InChI

InChI=1S/C21H32O5/c1-2-3-4-5-6-7-9-17(22)12-13-19-14-15-20(26-19)16-18(23)10-8-11-21(24)25/h6-7,12-15,17-18,22-23H,2-5,8-11,16H2,1H3,(H,24,25)/b7-6+,13-12+