3-phosphonooxypropyl (9E,12E,15E)-2-oxidanyloctadeca-9,12,15-trienoate

Systemtic Name: 3-phosphonooxypropyl (9E,12E,15E)-2-oxidanyloctadeca-9,12,15-trienoate Openeye Name: 3-phosphonooxypropyl (9E,12E,15E)-2-hydroxyoctadeca-9,12,15-trienoate CAS Name: (9E,12E,15E)-2-hydroxyoctadeca-9,12,15-trienoic acid 3-phosphonooxypropyl ester IUPAC Name: 3-phosphonooxypropyl (9E,12E,15E)-2-hydroxyoctadeca-9,12,15-trienoate Traditional Name: (9E,12E,15E)-2-hydroxyoctadeca-9,12,15-trienoic acid 3-phosphonooxypropyl ester Formula: C21H37O7P MolecularWeight: 432.488041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCC(C(=O)OCCCOP(=O)(O)O)O

Isomeric SMILES

CC/C=C/C/C=C/C/C=C/CCCCCCC(C(=O)OCCCOP(=O)(O)O)O

InChI

InChI=1S/C21H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20(22)21(23)27-18-16-19-28-29(24,25)26/h3-4,6-7,9-10,20,22H,2,5,8,11-19H2,1H3,(H2,24,25,26)/b4-3+,7-6+,10-9+