Ketcher 09021511162D 1   1.00000     0.00000     0

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  2  3  1  0     0  0
  4  2  1  0     0  0
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  1 22  1  0     0  0
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 23 24  1  0     0  0
 20 24  1  0     0  0
 21 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
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 28 29  1  0     0  0
 29 30  1  0     0  0
M  END
> <ID>
CHEBI:87767

> <NAME>
N-tetracosanoylglycine

> <DEFINITION>
An N-acylglycine in which the acyl group is specified as tetracosanoyl.

> <STAR>
3

> <SYNONYM>
Tetracosanoylglycine; tetracosanamidoacetic acid; N-lignoceroylglycine; 2-tetracosanamidoacetic acid

> <IUPAC_NAME>
N-tetracosanoylglycine

> <FORMULA>
C26H51NO3

> <MASS>
425.689

> <MONOISOTOPIC_MASS>
425.38689

> <CHARGE>
0

> <SMILES>
C(CCCCCCC(=O)NCC(O)=O)CCCCCCCCCCCCCCCC

> <INCHI>
InChI=1S/C26H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25(28)27-24-26(29)30/h2-24H2,1H3,(H,27,28)(H,29,30)

> <INCHIKEY>
ALGJSAHUUYIAIZ-UHFFFAOYSA-N

> <PUBMED_CITATION>
12810727

$$$$