LMPK12100037
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.2754   10.2080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9964   10.6243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7171   10.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7171    9.3450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4647    8.9135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2121    9.3450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2121   10.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4647   10.6399    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2754    9.3760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9964    8.9598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4647    8.0809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7480    7.6671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7480    6.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4647    6.4259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1813    6.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1813    7.6671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9331   10.6245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544   10.6243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9022    6.4235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.9598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.1273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4647    5.5934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9964    8.1273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4486    7.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0639    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  5 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
 15 19  1  0  0  0  0
 14 22  1  0  0  0  0
 10 23  1  0  0  0  0
  9 20  1  0  0  0  0
 20 21  2  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12100037

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7,3'-Dihydroxy-5,4'-dimethoxy-6-formyl-4-phenylcoumarin

> <FORMULA>
C18H14O7

> <MASS>
342.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Neoflavonoids [PK1210]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FCLXJEVYUOSEMG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H14O7/c1-23-14-4-3-9(5-13(14)21)10-6-16(22)25-15-7-12(20)11(8-19)18(24-2)17(10)15/h3-8,20-21H,1-2H3

> <SMILES>
C1(O)C(C=O)=C(OC)C2C(C3C=C(O)C(OC)=CC=3)=CC(=O)OC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14283883

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$