LMPK12110448
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0  0  0  0  0  0  0  0999 V2000
   12.7431    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7431    7.8008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6126    7.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4822    7.8008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4822    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6126    9.3070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3518    7.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2213    7.8008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2213    8.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3518    9.3070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3518    6.5160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0905    9.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9767    8.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8632    9.3069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8632   10.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9767   10.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0905   10.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8738    9.3069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6126    6.5155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.7491   10.8416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.5088   10.4031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8593    7.2568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0763    6.2442    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3132    7.2817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0979    9.3195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5416    8.6744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9850    8.8006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9777    7.7757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0834    7.2692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2020    7.7881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2093    8.8130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3278    9.3319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2436   10.3528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5796    9.0264    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
  1 18  1  0  0  0  0
 19  3  1  0  0  0  0
 15 20  1  0  0  0  0
 20 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 18  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
 32 33  2  0     0  0
 26 34  1  0     0  0
M  END
> <LM_ID>
LMPK12110448

> <COMMON_NAME>
Acacetin 7-(6''-methylglucuronide)

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-4'-methoxyflavone 7-(6"-methylglucuronide)

> <FORMULA>
C23H22O11

> <MASS>
474.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NCDRCVIENURMRZ-KHYDEXNFSA-N

> <INCHI>
InChI=1S/C23H22O11/c1-30-11-5-3-10(4-6-11)15-9-14(25)17-13(24)7-12(8-16(17)33-15)32-23-20(28)18(26)19(27)21(34-23)22(29)31-2/h3-9,18-21,23-24,26-28H,1-2H3/t18-,19-,20+,21-,23+/m0/s1

> <SMILES>
C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(=O)OC)O2)=CC2OC(C3C=CC(OC)=CC=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14482777

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 13432

> <CITATION>
-

$$$$