LMPK12110947
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
    8.9732   -5.8772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9732   -6.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8085   -7.3240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6439   -6.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6439   -5.8772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8085   -5.3949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4792   -7.3240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3145   -6.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3145   -5.8772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4792   -5.3949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4792   -8.2886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1498   -5.3952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0012   -5.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8524   -5.3952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8524   -4.4119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0012   -3.9205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1498   -4.4119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6877   -5.8772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6877   -3.9299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3145   -3.9299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1378   -5.3952    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8085   -8.2886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2718   -5.8953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9424   -8.7886    0.0000 C   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
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 17 20  1  0  0  0  0
  1 21  1  0  0  0  0
  3 22  1  0  0  0  0
 21 23  1  0     0  0
 22 24  1  0     0  0
M  END
> <LM_ID>
LMPK12110947

> <COMMON_NAME>
Isoetin 5,7-dimethyl ether

> <SYSTEMATIC_NAME>
2',4',5'-Trihydroxy-5,7-dimethoxyflavone

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WXKGXWMNWILBGO-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O7/c1-22-8-3-15(23-2)17-13(21)7-14(24-16(17)4-8)9-5-11(19)12(20)6-10(9)18/h3-7,18-20H,1-2H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258304

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 642575

> <CITATION>
-

$$$$