LMPK12140455
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    5.7139    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139    6.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4279    5.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1418    6.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1418    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4279    7.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8558    5.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5697    6.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5697    7.0606    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8558    7.4728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2834    7.4727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0111    7.0527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7388    7.4727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7388    8.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0111    8.7330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2834    8.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8558    5.1262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4279    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4662    8.7329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0111    9.5730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4662    7.0527    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
 19  1  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140455

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,7,3',4',5'-Pentahydroxyflavanone

> <FORMULA>
C15H12O7

> <MASS>
304.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
USQXPEWRYWRRJD-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H12O7/c16-7-3-8(17)14-9(18)5-12(22-13(14)4-7)6-1-10(19)15(21)11(20)2-6/h1-4,12,16-17,19-21H,5H2

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0126033

> <CHEBI_ID>
25882

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5258991

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$