LMPK12111625
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.2707    7.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2707    6.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9872    6.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7037    6.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7037    7.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9872    7.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4202    6.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1367    6.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1367    7.3155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4202    7.7292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4202    5.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8530    7.7290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5833    7.3074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3136    7.7290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3136    8.5722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5833    8.9939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8530    8.5722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8530    6.0747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.7290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9872    5.2474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1230    8.9938    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0436    7.3075    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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 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 12  1  0  0  0  0
  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
  3 20  1  0  0  0  0
 17 21  1  0  0  0  0
 14 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111625

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,5,7,2',5'-Pentahydroxyflavone

> <FORMULA>
C15H10O7

> <MASS>
302.04

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FYNCQVXZKZHSTM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O7/c16-6-1-2-9(18)8(3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,16-19,21H

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
190122

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258716

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$