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2-(hexadecanoylamino)-3-oxidanylidene-octadecanoic acid

2-(hexadecanoylamino)-3-oxidanylidene-octadecanoic acid

Systemtic Name:2-(hexadecanoylamino)-3-oxidanylidene-octadecanoic acid
Openeye Name:2-(hexadecanoylamino)-3-oxo-octadecanoic acid
CAS Name:3-oxo-2-(1-oxohexadecylamino)octadecanoic acid
IUPAC Name:2-(hexadecanoylamino)-3-oxooctadecanoic acid
Traditional Name:3-keto-2-palmitamido-stearic acid
Formula: C34H65NO4
MolecularWeight: 551.8842
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(=O)O)NC(=O)CCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(=O)O)NC(=O)CCCCCCCCCCCCCCC


InChI

InChI=1S/C34H65NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(36)33(34(38)39)35-32(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33H,3-30H2,1-2H3,(H,35,37)(H,38,39)


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