LMPK12050484
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0     0  0            999 V2000
    8.6030   10.2765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6030    9.2954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4527    8.8048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3023    9.2954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3023   10.2765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4527   10.7671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1518    8.8048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0015    9.2954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0015   10.2765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1518   10.7671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8509    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8509    7.7561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7592    7.2316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6677    7.7561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6677    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7592    9.3294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1518    7.8192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7537   10.7668    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4527    7.8242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7537    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7537    7.8264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9063    7.3371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9063    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.8254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7592   10.3774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5752    7.2322    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  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
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 16 25  1  0  0  0  0
 14 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050484

> <COMMON_NAME>
Diphysolone

> <SYSTEMATIC_NAME>
5,7,2',4'-Tetrahydroxy-6-prenylisoflavanone

> <FORMULA>
C20H20O6

> <MASS>
356.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AMCPULFLJZMXJI-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H20O6/c1-10(2)3-5-13-16(23)8-17-18(19(13)24)20(25)14(9-26-17)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)=C(O)C2C(=O)C(C3=C(O)C=C(O)C=C3)COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
180589

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 48133

> <CITATION>
-

$$$$