[(2S)-1-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-oxidanyl-propan-2-yl] (Z)-octadec-9-enoate

Systemtic Name: [(2S)-1-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-oxidanyl-propan-2-yl] (Z)-octadec-9-enoate Openeye Name: [(1S)-1-[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxymethyl]-2-hydroxy-ethyl] (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid [(2S)-1-hydroxy-3-[(9Z,12Z)-1-oxoheptadeca-9,12-dienoxy]propan-2-yl] ester IUPAC Name: [(2S)-1-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-hydroxypropan-2-yl] (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid [(1S)-1-[[(9Z,12Z)-heptadeca-9,12-dienoyl]oxymethyl]-2-hydroxy-ethyl] ester Formula: C38H68O5 MolecularWeight: 604.94352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC=CCC=CCCCC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C\C/C=C\CCCC

InChI

InChI=1S/C38H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36(34-39)35-42-37(40)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h10,12,16-19,36,39H,3-9,11,13-15,20-35H2,1-2H3/b12-10-,18-16-,19-17-/t36-/m0/s1