LMPK12110875
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    7.6111    8.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6111    7.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4898    7.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3684    7.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3684    8.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4898    9.4041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2471    7.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1258    7.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1258    8.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2471    9.4041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2471    6.5838    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0042    9.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8997    8.8870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7951    9.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7951   10.4380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8997   10.9550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0042   10.4380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4898    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8997   11.9888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6903    8.8870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.4039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6903   10.9549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2967   10.6047    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
  3 18  1  0  0  0  0
 16 19  1  0  0  0  0
 14 20  1  0  0  0  0
  1 21  1  0  0  0  0
 15 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110875

> <COMMON_NAME>
Tricetin 4'-methyl ether

> <SYSTEMATIC_NAME>
4'-methoxy-5,7,3',5'-tetrahydroxyflavone

> <FORMULA>
C16H12O7

> <MASS>
316.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2-(3,5-Dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one

> <INCHI_KEY>
ONKNGUOZRAKQPG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H12O7/c1-22-16-11(20)2-7(3-12(16)21)13-6-10(19)15-9(18)4-8(17)5-14(15)23-13/h2-6,17-18,20-21H,1H3

> <SMILES>
C1(O)=CC2OC(C3C=C(O)C(OC)=C(O)C=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0124868

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5491353

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 340645

> <CITATION>
-

$$$$