LMPK12050242
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0     0  0            999 V2000
    7.5868    9.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5868    8.1364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4414    7.6430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2959    8.1364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2959    9.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4414    9.6164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1505    7.6430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0050    8.1364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0050    9.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1505    9.6164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8592    7.6431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8592    6.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7729    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6865    6.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6865    7.6431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7729    8.1706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1505    6.6567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    9.6162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5993    6.0611    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4414    6.6567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4414   10.6027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5872   11.0960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5872   12.0823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7330   12.5755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4414   12.5755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4531    8.0856    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  1  0  0  0  0
  8  9  2  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
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
 14 19  1  0  0  0  0
  3 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 15 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050242

> <COMMON_NAME>
Gancaonin L

> <SYSTEMATIC_NAME>
5,7,3',4'-Tetrahydroxy-8-prenylisoflavone

> <FORMULA>
C20H18O6

> <MASS>
354.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WSOHPJFMARQRFD-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H18O6/c1-10(2)3-5-12-15(22)8-17(24)18-19(25)13(9-26-20(12)18)11-4-6-14(21)16(23)7-11/h3-4,6-9,21-24H,5H2,1-2H3

> <SMILES>
C1(O)C=C(O)C2C(=O)C(C3=CC(O)=C(O)C=C3)=COC=2C=1C/C=C(\C)/C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0038901

> <CHEBI_ID>
175550

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14604077

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74613

> <CITATION>
-

$$$$