LMPK12140168
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    6.6911    7.1313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6911    6.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4295    5.8523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1680    6.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1680    7.1313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4295    7.5577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9064    5.8523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6449    6.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6449    7.1313    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.9064    7.5577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3832    7.5576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1357    7.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8885    7.5576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8885    8.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1357    8.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3832    8.4266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9064    5.1305    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4295    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1063    7.4689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4295    8.3753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7134    8.7888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7312    9.6722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1790   10.1199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0716   10.1603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    9.8617    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  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140168

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7-Dihydroxy-8-C-(4-hydroxy-3-methyl-2-butenyl)flavanone

> <FORMULA>
C20H20O5

> <MASS>
340.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NJZDBTXUFHSOSG-KPKJPENVSA-N

> <INCHI>
InChI=1S/C20H20O5/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/h2-7,9,18,21-23H,8,10-11H2,1H3/b12-7+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
190778

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607869

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$