-OEChem-05031011042D

 10  9  0     1  0  0  0  0  0999 V2000
    4.5058   -2.8969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6333   -4.3969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0908   -5.3969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9633   -3.8969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3608   -5.3969    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3633   -4.3969    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5033   -3.8969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2333   -3.8969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0933   -4.3969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4935   -5.8947    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
  4  9  1  0  0  0  0
  6  5  1  6  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
669920

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
004226180

> <PUBCHEM_SUBSTANCE_SYNONYM>
4226-18-0
L-Aspartic acid, N-methyl- (9CI)
NSC 16206

> <PUBCHEM_GENERIC_REGISTRY_NAME>
4226-18-0

> <PUBCHEM_XREF_EXT_ID>
004226180

> <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=004226180

> <PUBCHEM_CID_ASSOCIATIONS>
92982  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
6  5  6

$$$$