[1-dodecanoyloxy-4,5,6-tris(oxidanyl)-2-oxidanylidene-hexan-3-yl] (E)-octadec-9-enoate

Systemtic Name: [1-dodecanoyloxy-4,5,6-tris(oxidanyl)-2-oxidanylidene-hexan-3-yl] (E)-octadec-9-enoate Openeye Name: [1-(2-dodecanoyloxyacetyl)-2,3,4-trihydroxy-butyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [4,5,6-trihydroxy-2-oxo-1-(1-oxododecoxy)hexan-3-yl] ester IUPAC Name: (1-dodecanoyloxy-4,5,6-trihydroxy-2-oxohexan-3-yl) (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [2,3,4-trihydroxy-1-(2-lauroyloxyacetyl)butyl] ester Formula: C36H66O8 MolecularWeight: 626.90444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(=O)C(C(C(CO)O)O)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(=O)C(C(C(CO)O)O)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C36H66O8/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-34(41)44-36(35(42)31(38)29-37)32(39)30-43-33(40)27-25-23-21-19-12-10-8-6-4-2/h15-16,31,35-38,42H,3-14,17-30H2,1-2H3/b16-15+