-OEChem-10191113482D

 13 12  0     1  0  0  0  0  0999 V2000
    7.9699   -2.3480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7833   -3.9438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2755   -6.1909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1291   -4.6938    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8041   -3.2147    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1341   -3.7147    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.9691   -3.3813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2741   -3.2147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2833   -5.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4041   -3.7147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4215   -4.6803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5341   -3.2147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6741   -3.7147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  2  0  0  0  0
  2  7  1  0  0  0  0
  3  9  2  0  0  0  0
  6  4  1  1  0  0  0
  4  9  1  0  0  0  0
  5 13  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
669837

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
001946823

> <PUBCHEM_SUBSTANCE_SYNONYM>
1946-82-3
EINECS 217-747-5
N(alpha)-Acetyllysine
N-alpha-Acetyl-L-lysine

> <PUBCHEM_GENERIC_REGISTRY_NAME>
1946-82-3

> <PUBCHEM_XREF_EXT_ID>
001946823

> <PUBCHEM_EXT_DATASOURCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/direct.jsp?result=advanced&regno=001946823

> <PUBCHEM_CID_ASSOCIATIONS>
92907  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
6  4  5

$$$$