[(2S)-1-hexadecanoyloxy-3-oxidanyl-propan-2-yl] (Z)-heptadec-9-enoate

Systemtic Name: [(2S)-1-hexadecanoyloxy-3-oxidanyl-propan-2-yl] (Z)-heptadec-9-enoate Openeye Name: [(1S)-1-(hexadecanoyloxymethyl)-2-hydroxy-ethyl] (Z)-heptadec-9-enoate CAS Name: (Z)-9-heptadecenoic acid [(2S)-1-hydroxy-3-(1-oxohexadecoxy)propan-2-yl] ester IUPAC Name: [(2S)-1-hexadecanoyloxy-3-hydroxypropan-2-yl] (Z)-heptadec-9-enoate Traditional Name: (Z)-heptadec-9-enoic acid [(1S)-1-(hexadecanoyloxymethyl)-2-hydroxy-ethyl] ester Formula: C36H68O5 MolecularWeight: 580.92212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\CCCCCCC

InChI

InChI=1S/C36H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(39)41-34(32-37)33-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17,34,37H,3-14,16,18-33H2,1-2H3/b17-15-/t34-/m0/s1