LMPK12050310
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0  0  0  0  0  0  0  0999 V2000
    7.2199    7.5233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2199    6.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9173    6.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6147    6.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6147    7.5233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9173    7.9260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3121    6.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0095    6.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0095    7.5233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3121    7.9260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7067    6.3156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7067    5.4546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4523    5.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1979    5.4546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1979    6.3156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4523    6.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3121    5.5105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9173    5.5105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9428    5.0246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9618    5.0246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5225    7.9260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8251    7.5233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8251    6.7181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5225    6.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1991    8.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3023    0.0000 C   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  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  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
  3 18  1  0  0  0  0
 14 19  1  0  0  0  0
 12 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24  2  1  0  0  0  0
 22 25  1  0  0  0  0
 22 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050310

> <COMMON_NAME>
Parvisoflavone B

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H16O6

> <MASS>
352.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YKYNYMQDXOWMDT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H16O6/c1-20(2)6-5-12-15(26-20)8-16-17(18(12)23)19(24)13(9-25-16)11-4-3-10(21)7-14(11)22/h3-9,21-23H,1-2H3

> <SMILES>
C12OC(C)(C)C=CC1=C(O)C1C(=O)C(C3C=CC(O)=CC=3O)=COC=1C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14550385

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$