LMPK12113018
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
    8.0528    9.0102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0528    8.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8319    7.6605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6111    8.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6111    9.0102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8319    9.4601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3902    7.6605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1694    8.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1694    9.0102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3902    9.4601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3902    6.7608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9485    9.4601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7425    9.0016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5366    9.4601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5366   10.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7425   10.8356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9485   10.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3158   10.8270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5287   10.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8319    6.7608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6190    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2735    9.4601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2735   10.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7425   11.7353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9554   12.4355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2735    7.6605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9485    7.6605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9485    6.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
 28 29  1  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
  1 22  1  0  0  0  0
 16 24  1  0  0  0  0
  2 26  1  0  0  0  0
  8 28  1  0  0  0  0
 15 18  1  0  0  0  0
  3 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113018

> <COMMON_NAME>
Quercetagetin hexamethyl ether

> <SYSTEMATIC_NAME>
3,5,6,7,3',4'-Hexamethoxyflavone

> <FORMULA>
C21H22O8

> <MASS>
402.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Hexamethylquercetagetin

> <INCHI_KEY>
CHXSDKWBSFDZEU-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C21H22O8/c1-23-12-8-7-11(9-13(12)24-2)18-21(28-6)17(22)16-14(29-18)10-15(25-3)19(26-4)20(16)27-5/h7-10H,1-6H3

> <SMILES>
C1(OC)=CC2OC(C3C=C(OC)C(OC)=CC=3)=C(OC)C(=O)C=2C(OC)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0029308

> <CHEBI_ID>
93682

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
386331

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2711

> <CITATION>
-

$$$$