LMPK12120199
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0     0  0            999 V2000
    9.8101   10.0892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8101    9.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7241    8.5063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6380    9.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6380   10.0892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7241   10.6168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5518    8.5063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4657    9.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4657   10.0892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3796   10.6168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2934   10.0892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2073   10.6168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2073   11.6719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2934   12.1996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3796   11.6719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5518    7.4510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7241    7.5966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9318   10.5963    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3687   10.5111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5667   12.1413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0783   10.1035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7099    5.5952    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9693    4.6067    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2482    5.6196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9904    7.6088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4949    6.9792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8564    7.1023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8493    6.1017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9762    5.6074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1158    6.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1229    7.1145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2624    7.6210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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 11  2  0  0  0  0
 11 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 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
  1 18  1  0  0  0  0
  5 19  1  0  0  0  0
 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
 26 32  1  0     0  0
 31 25  1  0     0  0
 25 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  1     0  0
 27 17  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
M  END
> <LM_ID>
LMPK12120199

> <COMMON_NAME>
Androechin

> <SYSTEMATIC_NAME>
2,2',6'-Trihydroxy-4'-methoxychalcone 2'-O-glucoside

> <FORMULA>
C22H24O10

> <MASS>
448.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DBDVNEPYCHFXLY-LPIGZASCSA-N

> <INCHI>
InChI=1S/C22H24O10/c1-30-12-8-15(26)18(14(25)7-6-11-4-2-3-5-13(11)24)16(9-12)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-9,17,19-24,26-29H,10H2,1H3/b7-6+/t17-,19-,20+,21-,22-/m1/s1

> <SMILES>
C1(OC)C=C(O)C(C(=O)/C=C/C2C(O)=CC=CC=2)=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178336290

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$