LMPK12110022
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
    7.4553    8.6997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4553    7.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3419    7.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2286    7.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2286    8.6997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3419    9.2115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151    7.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0017    7.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0017    8.6997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151    9.2115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151    6.3657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8881    9.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7917    8.6896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6953    9.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6953   10.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7917   10.7764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8881   10.2547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3862   10.6535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7380    9.1138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5750   10.2332    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5751   12.2366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3071   13.2338    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1772   10.7343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8626   13.2173    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3083   10.2311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4411   10.7318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4424   11.7360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3084   12.2344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1757   11.7336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0418   12.2322    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
 15 18  1  0  0  0  0
  1 19  1  0  0  0  0
 24 30  1  0     0  0
 29 23  1  0     0  0
 23 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  1     0  0
 26 20  1  6     0  0
 27 21  1  1     0  0
 28 22  1  6     0  0
 25  6  1  1     0  0
M  END
> <LM_ID>
LMPK12110022

> <COMMON_NAME>
Bayin

> <SYSTEMATIC_NAME>
8-beta-D-Glucopyranosyl-4',7-dihydroxyflavone

> <FORMULA>
C21H20O9

> <MASS>
416.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IAEWGSIPWPKEFT-UVPIGPOJSA-N

> <INCHI>
InChI=1S/C21H20O9/c22-8-15-17(26)18(27)19(28)21(30-15)16-12(24)6-5-11-13(25)7-14(29-20(11)16)9-1-3-10(23)4-2-9/h1-7,15,17-19,21-24,26-28H,8H2/t15-,17-,18+,19-,21+/m1/s1

> <SMILES>
C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21721991

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 24962

> <CITATION>
-

$$$$