Ketcher 05142014102D 1   1.00000     0.00000     0

 17 17  0     1  0            999 V2000
    5.9849  -10.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1739   -9.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1189   -8.9999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8747   -9.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8197   -9.3272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6858  -10.6365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7409  -10.9639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0401  -10.6365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2841   -9.9819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0951  -10.9639    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3393  -10.3093    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5833   -9.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6384   -9.9819    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
    2.7723   -8.6727    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4732   -8.9999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7172   -8.3453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4180   -8.6727    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  4  6  2  0     0  0
  6  7  1  0     0  0
  1  7  2  0     0  0
  1  8  1  0     0  0
  9  8  1  0     0  0
  9 10  1  1     0  0
  9 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 12 14  2  0     0  0
  9 15  1  0     0  0
 15 16  2  0     0  0
 15 17  1  0     0  0
M  CHG  1  17  -1
M  END
> <ID>
CHEBI:149739

> <NAME>
N-(fatty acyl)-L-tyrosine(1-)

> <DEFINITION>
an N-acyl-L-tyrosine where the fatty acyl chain is not specified, major species at pH 7.3

> <STAR>
2

> <SYNONYM>
N-fatty acyl-L-Tyr(1-); N-(fatty acyl)-L-tyrosinate; an N-(fatty acyl)-L-tyrosine

> <FORMULA>
C10H9NO4R

> <MASS>
207.183

> <MONOISOTOPIC_MASS>
207.05316

> <CHARGE>
-1

> <SMILES>
C=1(C=CC(O)=CC1)C[C@]([H])(NC(*)=O)C(=O)[O-]

> <PUBMED_CITATION>
32271712

$$$$