-OEChem-07191013252D

 16 18  0     0  0  0  0  0  0999 V2000
   27.1600  -14.5600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.1300  -14.8400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.6100  -18.6900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.7100  -14.5600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.3500  -16.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.6100  -17.3600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.8000  -16.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.3500  -15.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.8000  -15.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.6100  -14.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1600  -17.3600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.1300  -17.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.9000  -15.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.9700  -15.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.9000  -16.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4200  -19.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 13  1  0  0  0  0
  2  9  1  0  0  0  0
  2 14  1  0  0  0  0
  3  6  1  0  0  0  0
  3 16  1  0  0  0  0
  4 13  2  0  0  0  0
  5  6  1  0  0  0  0
  5  8  2  0  0  0  0
  5 11  1  0  0  0  0
  6  7  2  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  2  0  0  0  0
 11 15  2  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
4715

> <PUBCHEM_SUBSTANCE_VERSION>
6

> <PUBCHEM_EXT_DATASOURCE_NAME>
KEGG

> <PUBCHEM_EXT_DATASOURCE_REGID>
C01557

> <PUBCHEM_SUBSTANCE_COMMENT>
CAS: 484-20-8
ChEBI: 18293
KNApSAcK: C00000575
3DMET: B00318
NIKKAJI: J12.563F
Same as: D07521
Is a reactant or product of enzyme EC 2.1.1.69

> <PUBCHEM_SUBSTANCE_SYNONYM>
484-20-8
5-Methoxyfuranocoumarin
5-Methoxypsoralen
Bergapten
C01557
O-Methylbergaptol

> <PUBCHEM_GENERIC_REGISTRY_NAME>
484-20-8

> <PUBCHEM_XREF_EXT_ID>
C01557

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.genome.jp/kegg/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.genome.jp/dbget-bin/www_bget?cpd+C01557

> <PUBCHEM_CID_ASSOCIATIONS>
2355  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$