LMPK12110624
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    9.1798   -6.4394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9489   -7.8142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7426   -7.3701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7550   -6.4607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9735   -5.9953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5242   -7.8357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3180   -7.3915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3302   -6.4822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5487   -6.0169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5118   -8.7451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1241   -6.0382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9203   -6.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7294   -6.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7418   -5.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9453   -4.6587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1365   -5.1114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9365   -8.7235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9587   -3.6588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8313   -3.1704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6144   -4.6447    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4737   -5.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5886   -6.5715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5753   -7.5714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1675   -7.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2947   -7.8371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4356   -7.3254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3206   -5.9277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3341   -4.9278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1772   -7.9032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1637   -8.9031    0.0000 C   0  0  0  0  0  0  0  0  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  1  2  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  6 10  2  0  0  0  0
  8 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
  2 17  1  0  0  0  0
 15 18  1  0     0  0
 18 19  1  0     0  0
 14 20  1  0     0  0
 20 21  1  0     0  0
 13 22  1  0     0  0
 22 23  1  0     0  0
  1 24  1  0  0  0  0
 24  2  2  0  0  0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
  1 27  1  0     0  0
 27 28  1  0     0  0
  7 29  1  0     0  0
 29 30  1  0     0  0
M  END
> <LM_ID>
LMPK12110624

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-Hydroxy-3,6,7,3',4',5'-hexamethoxyflavone

> <FORMULA>
C21H22O9

> <MASS>
418.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XZKJITYVVLNMNW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H22O9/c1-24-12-7-10(8-13(25-2)19(12)27-4)18-21(29-6)17(23)15-11(30-18)9-14(26-3)20(28-5)16(15)22/h7-9,22H,1-6H3

> <SMILES>
C1(OC)C(OC)=C(O)C2C(=O)C(OC)=C(C3C=C(OC)C(OC)=C(OC)C=3)OC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14037441

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 25782

> <CITATION>
-

$$$$