Example Output from a Web Services Search for Isatin in SPRESI


==Input Molfile==
 
  DSViewer          2D                             0

 11 12  0  0  0  0  0  0  0  0999 V2000
  130.0000  232.0000    0.0000 C   0  0  0  0  0  0  0  0  0  1
  102.2872  216.0000    0.0000 C   0  0  0  0  0  0  0  0  0  2
  102.2872  184.0000    0.0000 C   0  0  0  0  0  0  0  0  0  3
  130.0000  168.0000    0.0000 C   0  0  0  0  0  0  0  0  0  4
  157.7128  184.0000    0.0000 C   0  0  0  0  0  0  0  0  0  5
  157.7128  216.0000    0.0000 C   0  0  0  0  0  0  0  0  0  6
  206.9557  200.0000    0.0000 C   0  0  0  0  0  0  0  0  0  7
  188.1466  174.1115    0.0000 C   0  0  0  0  0  0  0  0  0  8
  188.1466  225.8885    0.0000 N   0  0  0  0  0  0  0  0  0  9
  238.9557  200.0000    0.0000 O   0  0  0  0  0  0  0  0  0 10
  198.0352  143.6777    0.0000 O   0  0  0  0  0  0  0  0  0 11
  1  6  1  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  5  6  2  0  0  0
  7  8  1  0  0  0
  5  8  1  0  0  0
  6  9  1  0  0  0
  7  9  1  0  0  0
  7 10  2  0  0  0
  8 11  2  0  0  0
M  END


===Result of Search Exact Structure===
NLJ-GZI-BAF-BKBI_508946284

1 hits

HitKey: 0005145-400

===Document result===
<MOL>
<VIEW>DOCUMENT</VIEW>
<REGNO>0005145-400</REGNO>
<ROSDAL>
  INFOCHEM          2D 1   1.00000     0.00000     0

 11 12  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5  7  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  2  0  0  0  0
  9 10  1  0  0  0  0
M  END
</ROSDAL>

<MDATA>
<SUFO>C8H5NO2</SUFO>
<MOLWEIGHT>   147.13</MOLWEIGHT>
</MDATA>
<TRVNAMES>
<TRVNAME>2,3-Dihydro-2,3-dioxo-indol</TRVNAME>
<TRVNAME>2,3-Dioxoindolin</TRVNAME>
<TRVNAME>Dihydro-2,3 dioxo-2,3 indol</TRVNAME><TRVNAME>Dioxo-2,3 indoline</TRVNAME>
<TRVNAME>Indol dione-2,3</TRVNAME>
<TRVNAME>Indol-2,3-dion</TRVNAME><TRVNAME>Indolin-2,3-dion</TRVNAME>
<TRVNAME>Indoline dione-2,3</TRVNAME><TRVNAME>Isatin</TRVNAME>
<TRVNAME>Isatine</TRVNAME><TRVNAME>Isatinolactame</TRVNAME>
<TRVNAME>Isatinsaeure-lactam</TRVNAME>
</TRVNAMES>
<NAMES>
<NAME>1H-2,3-Dihydroindol-2,4-dion</NAME><NAME>1H-2,3-Dihydroindol-2,4-dione</NAME>
<NAME>1H-Indol-2,3-dion</NAME>
<NAME>1H-Indol-2,3-dione</NAME>
<NAME>1H-Indolin-2,3-dion</NAME><NAME>1H-Indolin-2,3-dione</NAME>
<NAME>2,3-Dihydro-1H-indan-2,3-dion</NAME>
<NAME>2,3-Dihydro-1H-indan-2,3-dione</NAME>
<NAME>2,3-Dihydro-1H-indol-2,3-dion</NAME>
<NAME>2,3-Dihydro-1H-indol-2,3-dione</NAME>
<NAME>2,3-Dihydro-2,3-dioxoindol</NAME>
<NAME>2,3-Dihydro-2,3-dioxoindole</NAME>
<NAME>2,3-Dihydroindol-2,3-dion</NAME>
<NAME>2,3-Dihydroindol-2,3-dione</NAME>
<NAME>ISATIN</NAME>
<NAME>Indol-2(1H),3-dion</NAME>
<NAME>Indol-2(1H),3-dione</NAME>
<NAME>Indol-2,3-dion</NAME>
<NAME>Indol-2,3-dione</NAME>
<NAME>Indolin-2,3-dion</NAME>
<NAME>Indolin-2,3-dione</NAME>
<NAME>Isatin</NAME>
<NAME>Isatine</NAME>
<NAME>2,3-Dioxoindol</NAME>
<NAME>2,3-Dioxoindole</NAME>
<NAME>Indol-1,2-dion</NAME>
<NAME>Indol-1,2-dione</NAME>
<NAME>1H-2,3-Dihydroindol-2,3-dion</NAME>
<NAME>1H-2,3-Dihydroindol-2,3-dione</NAME>
<NAME>Indolin-1,2-dion</NAME><NAME>Indolin-1,2-dione</NAME>
</NAMES>

<HASHCODES>
<HASHCODE>11048896-888152580</HASHCODE>
</HASHCODES>
<JRNSTAT>
<JRNCOUNT>370</JRNCOUNT><
/JRNSTAT>
<PATSTAT>
<PATCOUNT>37</PATCOUNT>
</PATSTAT>
<OTHSTAT>
<OTHCOUNT>5</OTHCOUNT>
</OTHSTAT>
<EDSTAT>
<EDCOUNT>1100</EDCOUNT>
</EDSTAT>
<PRSTAT>
<PRCOUNT>29</PRCOUNT>
</PRSTAT>

<REFS>

[only the first three and the 100th references are displayed in this example]

<REF NO="1">
<DOCID>0002484 76</DOCID>
<DOCTYPE>JOURNAL</DOCTYPE>
<AUTH>STRUMILLO J.</AUTH><CIT>ACTA POL. PHARM. &lt;APPH-AX&gt;, 1975, 32, NO 3, 287-292</CIT>
<YEAR>1975</YEAR>
<TITLE>SYNTHESE VON MANNICH-BASEN MIT ZU ERWARTENDER PHARMAKOLOGISCHER WIRKUNG.</TITLE>
<CODEN>APPHAX</CODEN>
<ISSN>0001-6837</ISSN><JOURNAL>ACTA POL. PHARM.</JOURNAL>
<VOLUME>32</VOLUME>
<NUMBER>3</NUMBER>
<PAGE>287-292</PAGE>
<LANG>POL</LANG>
<KEYWORDS>
<KEYWORD>Reaction: H-substitution at hetero by C (single bond)</KEYWORD>
</KEYWORDS>
</REF>

<REF NO="2"><DOCID>0002485 77</DOCID>
<DOCTYPE>JOURNAL</DOCTYPE>
<AUTH>MARCHETTI L.; ANDREANI A.</AUTH>
<CIT>ANN. CHIM. (ITAL.), 1973, 63, NO 9-10, 681-690</CIT>
<YEAR>1973</YEAR>
<TITLE>SYNTHESE UND OXYDATION VON 2-CHLOR-INDOLCARBALDEHYDEN.</TITLE>
<VOLUME>63</VOLUME>
<NUMBER>9-10</NUMBER>
<PAGE>681-690</PAGE>
<LANG>ITA</LANG>
<KEYWORDS>
<KEYWORD>Reaction: ring, ring opening</KEYWORD>
<KEYWORD>Reaction: H-substitution at hetero by C (single bond)</KEYWORD>
</KEYWORDS>
</REF>

<REF NO="3"><DOCID>0002502 79</DOCID>
<DOCTYPE>JOURNAL</DOCTYPE>
<AUTH>PROCTOR G. R.; SMITH B. M. L.</AUTH>
<CIT>J. CHEM. SOC. PERKIN TRANS. PART 1, 1978, NO 8, 862-870</CIT>
<YEAR>1978</YEAR>
<TITLE>AZABENZOCYCLOHEPTENONES. 19. BILDUNG VON HETEROCYCLISCHEN ANELLIERTEN VERBINDUNGEN AUS 
1,2,3,4-TETRAHYDRO-1-BENZAZEPINDERIVATEN.</TITLE>
<CODEN>JCPRB4</CODEN>
<ISSN>0300-922X</ISSN>
<JOURNAL>J. CHEM. SOC. PERKIN TRANS. 1</JOURNAL>
<NUMBER>8</NUMBER>
<PAGE>862-870</PAGE>
<LANG>ENG</LANG>
<KEYWORDS>
<KEYWORD>Reaction: ring, intermolecular cyclisation</KEYWORD>
</KEYWORDS>
</REF>
.
  .
    .
<snip>
      .
        .
          .
<REF NO="100">
<DOCID>11E0070 00</DOCID>
<DOCTYPE>JOURNAL</DOCTYPE>
<AUTH>Jnaneshwar G. K., Deshpande V. H.</AUTH>
<CIT>J. Chem. Res., Synop., (1999) 10, 632-633</CIT>
<YEAR>1999</YEAR>
<TITLE>Synthesis of convolutamydine A from isatin</TITLE>
<CODEN>JRPSDC</CODEN>
<ISSN>0308-2342</ISSN>
<JOURNAL>J. Chem. Res., Synop.</JOURNAL>
<NUMBER>10</NUMBER>
<PAGE>632-633</PAGE>
<LANG>ENG</LANG>
<KEYWORDS><KEYWORD>Reactant: substitution reaction</KEYWORD>
</KEYWORDS>
</REF>
</REFS>

<QSAR><LOGP>.44400001</LOGP>
<ROTB>0</ROTB>
<HACC>2</HACC>
<HDON>1</HDON></QSAR>
<ROSDAL>7N,10O,11O,1&gt;2,1&lt;6,2&lt;3,3&gt;4,4&lt;5,4!7,5&gt;6,5!9,7!8,8!9,8=11,9=10.</ROSDAL>
<MDATA>
<SUFO>C8H5NO2</SUFO>
<MOLWEIGHT>147.1333</MOLWEIGHT>
</MDATA>

<NAMES>
<NAME>Isatin</NAME></NAMES>
<SUPPLIERS>
<GROUP>10</GROUP>
<SUPPLIER>
<NAME>Acros</NAME>
<GROUP_ID>10</GROUP_ID>
<CATNOS><CATNO>15149</CATNO>
</CATNOS>
</SUPPLIER>

<GROUP>3</GROUP>
<SUPPLIER>
<NAME>Sigma-Aldrich</NAME>
<GROUP_ID>3</GROUP_ID>
<CATNOS>
<CATNO>58240</CATNO>
<CATNO>114618</CATNO>
</CATNOS>
</SUPPLIER>

<GROUP>7</GROUP>
<SUPPLIER>
<NAME>VWR</NAME>
<GROUP_ID>7</GROUP_ID>
<CATNOS>
<CATNO>AAA12468-22</CATNO>
<CATNO>AAA12468-36</CATNO>
<CATNO>AAAA12468-0E</CATNO>
<CATNO>TCI0080-025G</CATNO>
<CATNO>TCI0080-500G</CATNO>
</CATNOS>
</SUPPLIER>
</SUPPLIERS>
</MOL>