sodium [(2R)-2,3-di(octadecanoyloxy)propyl] hydrogen phosphate

Systemtic Name: sodium [(2R)-2,3-di(octadecanoyloxy)propyl] hydrogen phosphate Openeye Name: sodium [(2R)-2,3-di(octadecanoyloxy)propyl] hydrogen phosphate CAS Name: sodium [(2R)-2,3-bis(1-oxooctadecoxy)propyl] hydrogen phosphate IUPAC Name: sodium [(2R)-2,3-di(octadecanoyloxy)propyl] hydrogen phosphate Traditional Name: sodium [(2R)-2,3-distearoyloxypropyl] hydrogen phosphate Formula: C39H76NaO8P MolecularWeight: 726.979471

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)[O-])OC(=O)CCCCCCCCCCCCCCCCC.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)[O-])OC(=O)CCCCCCCCCCCCCCCCC.[Na+]

InChI

InChI=1S/C39H77O8P.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h37H,3-36H2,1-2H3,(H2,42,43,44);/q;+1/p-1/t37-;/m1./s1