sodium; 2,3-bis(oxidanyl)propyl (Z)-octadec-9-enoate; dihydrogen phosphate

Systemtic Name: sodium; 2,3-bis(oxidanyl)propyl (Z)-octadec-9-enoate; dihydrogen phosphate Openeye Name: sodium; dihydrogen phosphate; 2,3-dihydroxypropyl (Z)-octadec-9-enoate CAS Name: sodium; dihydrogen phosphate; (Z)-9-octadecenoic acid 2,3-dihydroxypropyl ester IUPAC Name: sodium; dihydrogen phosphate; 2,3-dihydroxypropyl (Z)-octadec-9-enoate Traditional Name: sodium; dihydrogen phosphate; (Z)-octadec-9-enoic acid glyceryl ester Formula: C21H42NaO8P MolecularWeight: 476.516911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O.OP(=O)(O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OCC(CO)O.OP(=O)(O)[O-].[Na+]

InChI

InChI=1S/C21H40O4.Na.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22;;1-5(2,3)4/h9-10,20,22-23H,2-8,11-19H2,1H3;;(H3,1,2,3,4)/q;+1;/p-1/b10-9-;;