[(2R)-2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-hexadec-9-enoate

Systemtic Name: [(2R)-2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-hexadec-9-enoate Openeye Name: [(2R)-2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] (E)-hexadec-9-enoate CAS Name: (E)-9-hexadecenoic acid [(2R)-2-[(E)-1-oxohexadec-9-enoxy]-3-phosphonooxypropyl] ester IUPAC Name: [(2R)-2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxypropyl] (E)-hexadec-9-enoate Traditional Name: (E)-hexadec-9-enoic acid [(2R)-2-[(E)-hexadec-9-enoyl]oxy-3-phosphonooxy-propyl] ester Formula: C35H65O8P MolecularWeight: 644.859561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCC=CCCCCCC

Isomeric SMILES

CCCCCC/C=C/CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCC/C=C/CCCCCC

InChI

InChI=1S/C35H65O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,33H,3-12,17-32H2,1-2H3,(H2,38,39,40)/b15-13+,16-14+/t33-/m1/s1