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2-(hexacosanoylamino)-3-methyl-butanoic acid

2-(hexacosanoylamino)-3-methyl-butanoic acid

Systemtic Name:2-(hexacosanoylamino)-3-methyl-butanoic acid
Openeye Name:2-(hexacosanoylamino)-3-methyl-butanoic acid
CAS Name:3-methyl-2-(1-oxohexacosylamino)butanoic acid
IUPAC Name:2-(hexacosanoylamino)-3-methylbutanoic acid
Traditional Name:2-(hexacosanoylamino)-3-methyl-butyric acid
Formula: C31H61NO3
MolecularWeight: 495.82094
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(C(C)C)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(C(C)C)C(=O)O


InChI

InChI=1S/C31H61NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29(33)32-30(28(2)3)31(34)35/h28,30H,4-27H2,1-3H3,(H,32,33)(H,34,35)


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