LMPK12111456
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    8.2638    7.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2638    6.4884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9964    6.0654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7291    6.4884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7291    7.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9964    7.7574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4618    6.0654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1945    6.4884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1945    7.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4618    7.7574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4618    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9269    7.7572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6735    7.3260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4204    7.7572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4204    8.6194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6735    9.0505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9269    8.6194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9964    5.2928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5281    7.8869    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0795    9.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6735    9.7168    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4745    6.0327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5812    9.1853    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.5347    9.1853    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.0000    8.6225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0452    8.0060    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1441    8.5690    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.5812    9.6477    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5347    9.6687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9964    8.5487    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2637    8.9717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5347    8.7632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0842    8.4459    0.0000 O   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
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 20 15  1  0  0  0  0
 21 16  1  0  0  0  0
  2 22  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 27 26  1  0  0  0  0
 27 23  1  0  0  0  0
 23 28  1  1  0  0  0
 27 19  1  6  0  0  0
 24 29  1  6  0  0  0
 24 32  1  6  0  0  0
  6 30  1  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111456

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,6,7,3',4'-Pentahydroxy-8-methoxyflavone 7-apioside

> <FORMULA>
C21H20O12

> <MASS>
464.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IXFAKKDXPKSFDT-PCCBWWKXSA-N

> <INCHI>
InChI=1S/C21H20O12/c1-30-18-16-13(11(25)5-12(32-16)8-2-3-9(23)10(24)4-8)14(26)15(27)17(18)33-20-19(28)21(29,6-22)7-31-20/h2-5,19-20,22-24,26-29H,6-7H2,1H3/t19-,20-,21+/m0/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@](CO)(O)CO2)=C(OC)C2OC(C3C=C(O)C(O)=CC=3)=CC(=O)C=2C(O)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258638

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$