2-(5-ethylhexadecanoyl)-2,3-bis(oxidanyl)-4-oxidanylidene-nonadecanoate

Systemtic Name: 2-(5-ethylhexadecanoyl)-2,3-bis(oxidanyl)-4-oxidanylidene-nonadecanoate Openeye Name: 2-(5-ethylhexadecanoyl)-2,3-dihydroxy-4-oxo-nonadecanoate CAS Name: 2-(5-ethyl-1-oxohexadecyl)-2,3-dihydroxy-4-oxononadecanoate IUPAC Name: 2-(5-ethylhexadecanoyl)-2,3-dihydroxy-4-oxononadecanoate Traditional Name: 2-(5-ethylhexadecanoyl)-2,3-dihydroxy-4-keto-nonadecanoate Formula: C37H69O6- MolecularWeight: 609.94016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(C(=O)CCCC(CC)CCCCCCCCCCC)(C(=O)[O-])O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(C(=O)CCCC(CC)CCCCCCCCCCC)(C(=O)[O-])O)O

InChI

InChI=1S/C37H70O6/c1-4-7-9-11-13-15-16-17-18-20-22-24-26-30-33(38)35(40)37(43,36(41)42)34(39)31-27-29-32(6-3)28-25-23-21-19-14-12-10-8-5-2/h32,35,40,43H,4-31H2,1-3H3,(H,41,42)/p-1