LMPK12130047
  LIPID_MAPS_STRUCTURE_DATABASE

 23 25  0  0  0  0  0  0  0  0999 V2000
    8.6049    8.2032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6049    9.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7568    9.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9086    9.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9086    8.2032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7568    7.7137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5362    7.9007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1120    8.6931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5362    9.4854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.6723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8334    8.6931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2773    8.6931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7678    7.8434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7488    7.8434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2392    8.6931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7488    9.5426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7678    9.5426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2185    8.6931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7720    7.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2384   10.3908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.7137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7568    6.7344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9240    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 22 23  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
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  4 10  1  0  0  0  0
  8 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 15 18  1  0  0  0  0
  7 19  2  0  0  0  0
 16 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12130047

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6,3',4'-Trihydroxy-4-methoxy-5-methylaurone

> <FORMULA>
C17H14O6

> <MASS>
314.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Aurone flavonoids [PK1213]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
APQPPUISLRYCEH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O6/c1-8-11(19)7-13-15(17(8)22-2)16(21)14(23-13)6-9-3-4-10(18)12(20)5-9/h3-7,18-20H,1-2H3

> <SMILES>
C12C(=O)C(=CC3C=C(O)C(O)=CC=3)OC=1C=C(O)C(C)=C2OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607777

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 529428

> <CITATION>
-

$$$$