LMPK12120578
  LIPID_MAPS_STRUCTURE_DATABASE

 22 23  0  0  0  0  0  0  0  0999 V2000
    5.7096    7.5818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7096    6.7602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4212    6.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1328    6.7602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1329    7.5818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4212    7.9926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8424    6.3504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5521    6.7602    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.2618    6.3504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9715    6.7602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6629    6.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3545    6.7602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3545    7.5587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6630    7.9579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9715    7.5587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8424    5.5311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.9915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0642    7.9684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5521    7.5796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0642    6.3504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4212    5.5300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3389    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  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  1  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
  1 17  1  0  0  0  0
 13 18  1  0  0  0  0
  8 19  1  0  0  0  0
 12 20  1  0  0  0  0
  3 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120578

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3,4,4',alpha-Tetrahydroxy-2'-methoxydihydrochalcone

> <FORMULA>
C16H16O6

> <MASS>
304.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BNOLOXUNKKENIR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H16O6/c1-22-15-8-10(17)3-4-11(15)16(21)14(20)7-9-2-5-12(18)13(19)6-9/h2-6,8,14,17-20H,7H2,1H3

> <SMILES>
C1(O)C=CC(C(=O)C(O)CC2C=CC(O)=C(O)C=2)=C(OC)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607725

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$