2,3-bis(oxidanyl)propyl octadecanoate; octadecanoate

Systemtic Name: 2,3-bis(oxidanyl)propyl octadecanoate; octadecanoate Openeye Name: 2,3-dihydroxypropyl octadecanoate; octadecanoate CAS Name: octadecanoate; octadecanoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl octadecanoate; octadecanoate Traditional Name: stearate; stearic acid glyceryl ester Formula: C39H77O6- MolecularWeight: 642.02508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O

InChI

InChI=1S/C21H42O4.C18H36O2/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;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h20,22-23H,2-19H2,1H3;2-17H2,1H3,(H,19,20)/p-1