LMPK12140638
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.5936    8.5287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5936    7.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4914    6.9737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3891    7.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3891    8.5287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4914    9.0470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2869    6.9737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1847    7.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1847    8.5287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2869    9.0470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1378    9.0791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0356    8.5607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9333    9.0791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9333   10.1157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0356   10.6340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1378   10.1157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2869    6.0614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4914    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7629    9.0083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7542    7.0075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0652    7.4052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.6029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7347    8.6163    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8448   10.6419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6903   10.1537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0356   11.6231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8780   12.1094    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 13 23  1  0  0  0  0
 14 24  1  0  0  0  0
 24 25  1  0  0  0  0
 15 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140638

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5,3'-Dihydroxy-6,7,4',5'-tetramethoxyflavanone

> <FORMULA>
C19H20O8

> <MASS>
376.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ABIJRPKPVBZTCW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H20O8/c1-23-14-6-9(5-11(21)18(14)25-3)12-7-10(20)16-13(27-12)8-15(24-2)19(26-4)17(16)22/h5-6,8,12,21-22H,7H2,1-4H3

> <SMILES>
C1(OC)C=C2OC(C3C=C(OC)C(OC)=C(O)C=3)CC(=O)C2=C(O)C=1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
193386

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10833336

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 106453

> <CITATION>
11141119

$$$$