(2-hexadecanoyloxy-3-oxidanyl-propyl) (8E,11E,14E,17E)-icosa-8,11,14,17-tetraenoate

Systemtic Name: (2-hexadecanoyloxy-3-oxidanyl-propyl) (8E,11E,14E,17E)-icosa-8,11,14,17-tetraenoate Openeye Name: (2-hexadecanoyloxy-3-hydroxy-propyl) (8E,11E,14E,17E)-icosa-8,11,14,17-tetraenoate CAS Name: (8E,11E,14E,17E)-eicosa-8,11,14,17-tetraenoic acid [3-hydroxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: (2-hexadecanoyloxy-3-hydroxypropyl) (8E,11E,14E,17E)-icosa-8,11,14,17-tetraenoate Traditional Name: (8E,11E,14E,17E)-eicosa-8,11,14,17-tetraenoic acid (2-hexadecanoyloxy-3-hydroxy-propyl) ester Formula: C39H68O5 MolecularWeight: 616.95422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCC=CCC=CCC=CCC=CCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCC/C=C/C/C=C/C/C=C/C/C=C/CC

InChI

InChI=1S/C39H68O5/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-21-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20,22,37,40H,3-4,6,8-10,12,14-16,19,21,23-36H2,1-2H3/b7-5+,13-11+,18-17+,22-20+