LMPK12111618
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    5.0000    7.3138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7159    6.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4318    6.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4318    7.3138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7159    7.7271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1477    6.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8637    6.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8637    7.3138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1477    7.7271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1477    5.4293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793    7.7270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089    7.3058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0386    7.7270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0386    8.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089    8.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793    8.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793    6.0740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7159    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7680    8.9906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7680    7.3058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3089    9.8331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7159    8.5535    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
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
  6 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111618

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,5,8,3',4',5'-Hexahydroxyflavone

> <FORMULA>
C15H10O8

> <MASS>
318.04

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JGTKWAPKKUUANC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O8/c16-6-1-2-7(17)15-10(6)12(21)13(22)14(23-15)5-3-8(18)11(20)9(19)4-5/h1-4,16-20,22H

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0037357

> <CHEBI_ID>
175073

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258711

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$