-OEChem-04131210272D

 17 18  0     1  0  0  0  0  0999 V2000
   -2.1650   -0.2705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5227    1.9191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8770    1.4790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7605   -1.7615    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3689   -0.0848    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0241   -0.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7605   -0.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0241   -1.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7385   -0.2691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2455   -1.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4530   -0.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0146    0.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7385   -1.9191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4530   -1.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8188    0.5262    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.0728    1.3081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8770   -0.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  1 17  1  0  0  0  0
  2 16  2  0  0  0  0
  3 16  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 11  1  0  0  0  0
 11 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
24896893

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
Sigma-Aldrich

> <PUBCHEM_EXT_DATASOURCE_REGID>
M4001_SIGMA

> <PUBCHEM_SUBSTANCE_SYNONYM>
5-Methoxy-DL-tryptophan
M4001_SIGMA

> <PUBCHEM_XREF_EXT_ID>
M4001_SIGMA

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.sigmaaldrich.com?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.sigmaaldrich.com/catalog/search/ProductDetail/SIGMA/M4001?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_CID_ASSOCIATIONS>
119802  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$