LMPK12050033
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0  0  0  0  0  0  0  0999 V2000
    7.5726   11.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5726   10.4827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4129    9.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2531   10.4827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2531   11.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4129   11.9381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0934    9.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9339   10.4827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9339   11.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0934   11.9381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7736    9.9979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7736    8.9604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6720    8.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5705    8.9604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5705    9.9979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6720   10.5165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0934    9.0277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.9379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6720    7.4044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5705    6.8857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4689    7.4044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4689    8.4417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7485    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3942    7.4044    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
  1 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 14  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050033

> <COMMON_NAME>
Corylin

> <SYSTEMATIC_NAME>
3-(2,2-Dimethyl-2H-1-benzopyran-6-yl)-7-hydroxy-4H-1-benzopyran-4-one

> <FORMULA>
C20H16O4

> <MASS>
320.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PWAACAMQKVIVPZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H16O4/c1-20(2)8-7-13-9-12(3-6-17(13)24-20)16-11-23-18-10-14(21)4-5-15(18)19(16)22/h3-11,21H,1-2H3

> <SMILES>
C1(O)=CC2OC=C(C3C=CC4OC(C)(C)C=CC=4C=3)C(=O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
45980

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5316097

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 429560

> <CITATION>
-

$$$$