LMPK12140125
  LIPID_MAPS_STRUCTURE_DATABASE

 20 22  0  0  0  0  0  0  0  0999 V2000
    5.7123    6.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4252    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1380    6.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1380    7.0572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4252    7.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7123    7.0572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8510    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5640    6.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5640    7.0572    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8510    7.4689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2762    7.4685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8510    5.1053    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0075    7.0462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7390    7.4685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7390    8.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0075    8.7352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2762    8.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4252    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5460    8.7345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  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  4  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 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 17  2  0  0  0  0
 17 11  1  0  0  0  0
  2 18  1  0  0  0  0
 17 19  1  0  0  0  0
  6 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140125

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7,2'-Trihydroxyflavanone

> <FORMULA>
C15H12O5

> <MASS>
272.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LSLXUDALHVEMQB-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H12O5/c16-8-5-11(18)15-12(19)7-13(20-14(15)6-8)9-3-1-2-4-10(9)17/h1-6,13,16-18H,7H2

> <SMILES>
C1C(O)=CC2OC(C3C(O)=CC=CC=3)CC(=O)C=2C=1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186764

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
179999

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$