-OEChem-09151010582D

 17 16  0     0  0  0  0  0  0999 V2000
    5.3210   -1.9954    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.3210   -3.3256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9908   -1.9954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3210   -0.6651    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6513   -1.9954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4726   -3.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3256   -3.1469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4726    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6241   -3.3256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9954   -3.1469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6241   -0.6651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7757   -3.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3303   -4.2985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7757    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9273   -3.3256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -4.2985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9273   -0.6651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
48425703

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
EPA DSSTox

> <PUBCHEM_EXT_DATASOURCE_REGID>
34066

> <PUBCHEM_SUBSTANCE_COMMENT>
Substance included in EPA DSSTox NTPHTS: National Toxicology Program (NTP) High Throughput Screening Project Structure-Index File <a href="http://www.epa.gov/ncct/dsstox/sdf_ntphts.html"target="_blank">[link to DSSTox SDF Download Page]</a>
Structure Shown: tested chemical
For further information visit the National Institute of Environmental Health Sciences (NIEHS) NTP High Throughput Screening Initiative <a href="http://ntp.niehs.nih.gov/index.cfm?objectid=05F80E15-F1F6-975E-77DDEDBDF3B941CD"target="_blank">Website</a>

> <PUBCHEM_SUBSTANCE_SYNONYM>
126-73-8
Tributyl phosphate

> <PUBCHEM_GENERIC_REGISTRY_NAME>
126-73-8

> <PUBCHEM_XREF_EXT_ID>
34066

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

> <PUBCHEM_CID_ASSOCIATIONS>
31357  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$