-OEChem-05191010082D

  8  8  0     0  0  0  0  0  0999 V2000
    4.6698   -2.1403    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8921    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.2626    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4523   -1.5955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5913   -0.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5592   -1.1508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3015   -2.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1508   -1.5955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
48416084

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
EPA DSSTox

> <PUBCHEM_EXT_DATASOURCE_REGID>
23125

> <PUBCHEM_SUBSTANCE_COMMENT>
Substance included in EPA DSSTox FDAMDD: FDA Maximum (Recommended) Daily Dose Database File <a href="http://www.epa.gov/ncct/dsstox/sdf_fdamdd.html"target="_blank">[link to DSSTox SDF Download Page]</a>
Structure Shown: tested chemical
For further information visit the FDA Maximum Recommended Therapeutic Dose Database <a href="http://www.fda.gov/AboutFDA/CentersOffices/CDER/ucm092199.htm"target="_blank">Website</a>

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-(1H-imidazol-5-yl)ethanamine
51-45-6
Histamine

> <PUBCHEM_GENERIC_REGISTRY_NAME>
51-45-6

> <PUBCHEM_XREF_EXT_ID>
23125

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.epa.gov/ncct/dsstox/sdf_fdamdd.html

> <PUBCHEM_CID_ASSOCIATIONS>
774  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$