LMPK12050479
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0     0  0            999 V2000
    7.6225    9.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6225    8.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5128    7.4905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4033    8.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4033    9.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5128    9.5470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2936    7.4905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1842    8.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1842    9.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2936    9.5470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.5466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2936    6.4636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0740    7.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0740    6.5374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8997    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7254    6.5374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7254    7.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8997    7.9677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5497    6.0614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5128    6.4630    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5128   10.5745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4028   11.0880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4028   12.1131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2809   12.6202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6565   12.5440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2499    6.0614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  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 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 13  2  0  0  0  0
 16 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
 14 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050479

> <COMMON_NAME>
Kievitone

> <SYSTEMATIC_NAME>
3-(2,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C20H20O6

> <MASS>
356.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MERHMOCEIBOOMA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H20O6/c1-10(2)3-5-13-16(23)8-17(24)18-19(25)14(9-26-20(13)18)12-6-4-11(21)7-15(12)22/h3-4,6-8,14,21-24H,5,9H2,1-2H3

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2OCC(C3=CC=C(O)C=C3O)C(=O)C=2C(O)=C1

> <KEGG_ID>
C01590

> <HMDB_ID>
HMDB0034213

> <CHEBI_ID>
16832

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
119269

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 271790

> <CITATION>
-

$$$$