-OEChem-04131210282D

 27 29  0     0  0  0  0  0  0999 V2000
   28.6022  -19.1936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.6022  -21.6684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.3165  -20.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8878  -19.6060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3165  -19.6060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1735  -19.1936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6022  -20.8435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8878  -20.4310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.0541  -20.8721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.0541  -19.1650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.4590  -19.6060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1735  -18.3687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.8014  -20.4481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.8014  -19.5889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7447  -19.1936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.4590  -17.9562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7447  -18.3687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1734  -20.8435    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   30.0446  -21.6970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   30.0446  -18.3400    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.4589  -20.4310    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.8880  -17.9561    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.5143  -20.8633    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.5143  -19.1737    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.0302  -19.6061    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.4589  -17.1312    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.0302  -17.9562    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  7  2  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  3  9  2  0  0  0  0
  4  6  1  0  0  0  0
  4  8  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  8 18  1  0  0  0  0
  9 13  1  0  0  0  0
  9 19  1  0  0  0  0
 10 14  1  0  0  0  0
 10 20  1  0  0  0  0
 11 15  1  0  0  0  0
 11 21  1  0  0  0  0
 12 16  2  0  0  0  0
 12 22  1  0  0  0  0
 13 14  2  0  0  0  0
 13 23  1  0  0  0  0
 14 24  1  0  0  0  0
 15 17  2  0  0  0  0
 15 25  1  0  0  0  0
 16 17  1  0  0  0  0
 16 26  1  0  0  0  0
 17 27  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
126524719

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
811

> <PUBCHEM_EXT_DATASOURCE_REGID>
HMDB03075

> <PUBCHEM_SUBSTANCE_COMMENT>
Biofluids: Blood

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-Phenyl-4-chromone
2-Phenyl-4H-1-benzopyran-4-one
2-Phenyl-4H-benzopyran-4-one
2-Phenyl-4H-chromen-4-one
2-Phenylbenzopyran-4-one
2-Phenylchromone
Flavone
HMDB03075

> <PUBCHEM_XREF_EXT_ID>
HMDB03075

> <PUBCHEM_PUBMED_ID>
1410875
3167843
3235538
8313372
11449670
12478564
12589031
12787887
15828058
16300739

> <PUBCHEM_EXT_DATASOURCE_URL>
http://hmdb.ca

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://hmdb.ca/metabolites/HMDB03075

> <PUBCHEM_CID_ASSOCIATIONS>
10680  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$