LMPK12140169
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.1334    7.3579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1334    6.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8646    6.0915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5958    6.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5958    7.3579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8646    7.7801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3270    6.0915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0582    6.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0582    7.3579    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.3270    7.7801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7891    7.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5344    7.3496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2797    7.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2797    8.6405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5344    9.0707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7891    8.6405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3270    5.3767    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8646    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.6922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8646    8.5896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1555    8.9991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1555    9.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8382   10.2679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5248   10.2269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5248   10.9657    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
  9 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
  1 19  1  0  0  0  0
  6 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
 24 25  2  0  0  0  0
M  END
> <LM_ID>
LMPK12140169

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7-Dihydroxy-8-C-(gamma-methyl-gamma-formylallyl)flavanone

> <FORMULA>
C20H18O5

> <MASS>
338.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZJSBETNMBPEILM-KPKJPENVSA-N

> <INCHI>
InChI=1S/C20H18O5/c1-12(11-21)7-8-14-15(22)9-16(23)19-17(24)10-18(25-20(14)19)13-5-3-2-4-6-13/h2-7,9,11,18,22-23H,8,10H2,1H3/b12-7+

> <SMILES>
C1(O)=C(C/C=C(/C=O)\C)C2OC(C3C=CC=CC=3)CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607870

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$