LMPK12160015
  LIPID_MAPS_STRUCTURE_DATABASE

 22 25  0     0  0            999 V2000
    7.5743    9.3778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5743    8.4057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4162    7.9196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2580    8.4057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2580    9.3778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4162    9.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1001    7.9196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9420    8.4057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9420    9.3778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1001    9.8640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7836    7.9197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7836    6.8803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6838    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5838    6.8803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5838    7.9197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6838    8.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9208    6.3823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7836    9.8638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5724    6.5591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1834    7.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5724    8.2409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 11  2  0  0  0  0
  1  2  1  0  0  0  0
 12 17  1  0  0  0  0
  9 18  2  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
  1 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12160015

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7,2'-Dihydroxy-4',5'-methylenedioxy-3-phenylcoumarin

> <FORMULA>
C16H10O6

> <MASS>
298.05

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Other Flavonoids [PK1216]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XAIBLYCUSHEJPN-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H10O6/c17-9-2-1-8-3-11(16(19)22-13(8)4-9)10-5-14-15(6-12(10)18)21-7-20-14/h1-6,17-18H,7H2

> <SMILES>
C1(O)C=CC2C=C(C3=CC4OCOC=4C=C3O)C(=O)OC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260103

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1030150

> <CITATION>
-

$$$$