LMPK12112528
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.1030    9.1786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1030    8.2452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9113    7.7785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7197    8.2452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7197    9.1786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9113    9.6453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5280    7.7785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3363    8.2452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3363    9.1786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5280    9.6453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5280    6.8450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1447    9.6453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9685    9.1698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7923    9.6453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7923   10.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9685   11.0723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1447   10.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9113    6.8450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3363   11.0632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6006    9.1786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6006    7.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6006   11.0632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6388   10.4640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1447    7.7784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1447    6.3256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    9.6453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945   11.0983    0.0000 C   0  0  0  0  0  0  0  0  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
  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
  3 18  1  0  0  0  0
 17 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 22  1  0  0  0  0
  8 24  1  0  0  0  0
  1 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112528

> <COMMON_NAME>
Chrysosplenol E

> <SYSTEMATIC_NAME>
5,2'-Dihydroxy-3,7,4',5'-tetramethoxyflavone

> <FORMULA>
C19H18O8

> <MASS>
374.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GNJVUACZJGJODM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O8/c1-23-9-5-12(21)16-15(6-9)27-18(19(26-4)17(16)22)10-7-13(24-2)14(25-3)8-11(10)20/h5-8,20-21H,1-4H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5315857

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 61245

> <CITATION>
-

$$$$