-OEChem-10201113252D

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  870.6800   96.5297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -348.3650  -14.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  870.6800  170.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -476.6770   59.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  999.0000   96.5297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -284.2010   96.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  806.5150   59.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -412.5210  -51.6370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  934.8350  207.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -476.6770  -14.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  999.0000  170.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -464.9030  148.9300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  999.0000   22.4419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -348.3650  133.5830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  882.4440    7.0945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -220.0360   59.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  742.3600   96.5297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  806.5150  207.6520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 -155.8810   96.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -91.7252   59.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  614.0400   96.5297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  293.2350   59.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  100.7590  170.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  421.5640  -14.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  7  1  0  0  0  0
  1 15  1  1  0  0  0
  1 17  1  6  0  0  0
  2  4  1  0  0  0  0
  2  8  1  0  0  0  0
  2 16  1  1  0  0  0
  2 18  1  6  0  0  0
  3  5  2  0  0  0  0
  3  9  1  0  0  0  0
  4  6  2  0  0  0  0
  4 10  1  0  0  0  0
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  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
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M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
585039

> <PUBCHEM_SUBSTANCE_VERSION>
9

> <PUBCHEM_EXT_DATASOURCE_NAME>
BioCyc

> <PUBCHEM_EXT_DATASOURCE_REGID>
CPD1F-129

> <PUBCHEM_SUBSTANCE_COMMENT>
TYPES: Carotenes
Is a product of enzyme EC 5.5.1.-
Is a reactant of enzyme EC 1.14.99.-
Is a reactant of enzyme EC 1.14.99.36
Is a reactant of enzyme EC 1.14.13.129

> <PUBCHEM_SUBSTANCE_SYNONYM>
7235-40-7
CPD1F-129
beta-carotene

> <PUBCHEM_GENERIC_REGISTRY_NAME>
7235-40-7

> <PUBCHEM_XREF_EXT_ID>
CPD1F-129

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.biocyc.org

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://biocyc.org/META/NEW-IMAGE?type=COMPOUND&object=CPD1F-129

> <PUBCHEM_CID_ASSOCIATIONS>
5280489  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
1  15  5
1  17  6
2  16  5
2  18  6

$$$$