[4-(hexadecanoyloxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl hexadecanoate

Systemtic Name: [4-(hexadecanoyloxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl hexadecanoate Openeye Name: [4-(hexadecanoyloxymethyl)-5-hydroxy-6-methyl-3-pyridyl]methyl hexadecanoate CAS Name: hexadecanoic acid [5-hydroxy-6-methyl-4-(1-oxohexadecoxymethyl)-3-pyridinyl]methyl ester IUPAC Name: [4-(hexadecanoyloxymethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl hexadecanoate Traditional Name: palmitic acid [4-(hexadecanoyloxymethyl)-5-hydroxy-6-methyl-3-pyridyl]methyl ester Formula: C40H71NO5 MolecularWeight: 645.99544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1=CN=C(C(=C1COC(=O)CCCCCCCCCCCCCCC)O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC1=CN=C(C(=C1COC(=O)CCCCCCCCCCCCCCC)O)C

InChI

InChI=1S/C40H71NO5/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-38(42)45-33-36-32-41-35(3)40(44)37(36)34-46-39(43)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32,44H,4-31,33-34H2,1-3H3