(3-oxidanyl-2-tetradecanoyloxy-propyl) (9E,12E,15E)-octadeca-9,12,15-trienoate

Systemtic Name: (3-oxidanyl-2-tetradecanoyloxy-propyl) (9E,12E,15E)-octadeca-9,12,15-trienoate Openeye Name: (3-hydroxy-2-tetradecanoyloxy-propyl) (9E,12E,15E)-octadeca-9,12,15-trienoate CAS Name: (9E,12E,15E)-octadeca-9,12,15-trienoic acid [3-hydroxy-2-(1-oxotetradecoxy)propyl] ester IUPAC Name: (3-hydroxy-2-tetradecanoyloxypropyl) (9E,12E,15E)-octadeca-9,12,15-trienoate Traditional Name: (9E,12E,15E)-octadeca-9,12,15-trienoic acid (3-hydroxy-2-tetradecanoyloxy-propyl) ester Formula: C35H62O5 MolecularWeight: 562.86378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC=CCC=CCC=CCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCC/C=C/C/C=C/C/C=C/CC

InChI

InChI=1S/C35H62O5/c1-3-5-7-9-11-13-15-16-17-18-20-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-19-14-12-10-8-6-4-2/h5,7,11,13,16-17,33,36H,3-4,6,8-10,12,14-15,18-32H2,1-2H3/b7-5+,13-11+,17-16+