LMPK12112478
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
   11.9832    8.5580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9832    7.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8484    7.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7137    7.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7137    8.5580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8484    9.0576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5789    7.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4444    7.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4444    8.5580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5789    9.0576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5789    6.2803    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3094    9.0575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1913    8.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0731    9.0575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0731   10.0758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1913   10.5849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3094   10.0758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1182    9.0575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8484    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3094    7.0595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9383   10.5754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9383    8.5578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1913   11.5841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0566   12.0837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5865    7.1280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6494    6.6237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2491    8.0475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4468    9.5180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8734    9.5557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1522    8.8046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8864    7.8399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9151    7.5884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2151    8.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4809    9.2650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7808    9.9770    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
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
  8 20  1  0  0  0  0
 15 21  1  0  0  0  0
 14 22  1  0  0  0  0
 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
 29 35  1  0     0  0
 34 28  1  0     0  0
 28 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  1     0  0
 30 18  1  1     0  0
 31 25  1  6     0  0
 32 26  1  1     0  0
 33 27  1  6     0  0
M  END
> <LM_ID>
LMPK12112478

> <COMMON_NAME>
Laricitrin 7-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H22O13

> <MASS>
494.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MIXPHKVHUNRPCY-ROSPJSJWSA-N

> <INCHI>
InChI=1S/C22H22O13/c1-32-12-3-7(2-10(25)15(12)26)21-19(30)17(28)14-9(24)4-8(5-11(14)34-21)33-22-20(31)18(29)16(27)13(6-23)35-22/h2-5,13,16,18,20,22-27,29-31H,6H2,1H3/t13-,16-,18+,20-,22-/m1/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=C(OC)C(O)=C(O)C=3)=C(O)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5491649

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$