LMPK12111238
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
    6.2436    7.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2436    6.4412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9328    6.0433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6219    6.4412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6219    7.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9328    7.6347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3110    6.0433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0001    6.4412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0001    7.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3110    7.6347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3110    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6893    7.6347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3916    7.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0939    7.6347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0939    8.4457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3916    8.8512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6893    8.4457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.0433    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9328    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3916    9.6468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.6347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7830    8.8436    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6681    8.3325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  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
  2 18  1  0  0  0  0
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
  1 21  1  0  0  0  0
 15 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111238

> <COMMON_NAME>
Nuchensin

> <SYSTEMATIC_NAME>
5,6,3'-Trihydroxy-7,4'-dimethoxyflavone

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GCKIPZDMMOATHU-UHFFFAOYSA-N

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

> <SMILES>
C1(OC)=CC2OC(C3C=C(O)C(OC)=CC=3)=CC(=O)C=2C(O)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
373260

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$