butanedioate; (2-hexadecanoyloxy-3-phosphonooxy-propyl) hexadecanoate

Systemtic Name: butanedioate; (2-hexadecanoyloxy-3-phosphonooxy-propyl) hexadecanoate Openeye Name: butanedioate; (2-hexadecanoyloxy-3-phosphonooxy-propyl) hexadecanoate CAS Name: butanedioate; hexadecanoic acid [2-(1-oxohexadecoxy)-3-phosphonooxypropyl] ester IUPAC Name: butanedioate; (2-hexadecanoyloxy-3-phosphonooxypropyl) hexadecanoate Traditional Name: palmitic acid (2-hexadecanoyloxy-3-phosphonooxy-propyl) ester; succinate Formula: C39H73O12P-2 MolecularWeight: 764.963481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C35H69O8P.C4H6O4/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;5-3(6)1-2-4(7)8/h33H,3-32H2,1-2H3,(H2,38,39,40);1-2H2,(H,5,6)(H,7,8)/p-2