LMPK12112766
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
    8.9434    8.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9434    7.4838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7650    7.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5866    7.4838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5866    8.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7650    8.9067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4081    7.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2297    7.4838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2297    8.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4081    8.9067    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4081    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0513    8.9066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8888    8.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7260    8.9066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7260    9.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8888   10.3569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0513    9.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7650    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0411    8.7255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4835    7.9580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0411    7.1906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5348    7.9580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.7795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8888   11.3056    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1677   12.0440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0513    7.0093    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3305    7.7478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5475   10.3478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8265    9.6094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 25 26  1  0  0  0  0
 27 28  1  0  0  0  0
 29 30  1  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
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21  2  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 15 29  1  0  0  0  0
 16 25  1  0  0  0  0
  8 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112766

> <COMMON_NAME>
Velloquercetin 3,3',4'-trimethyl ether

> <SYSTEMATIC_NAME>
5-Hydroxy-3,3',4'-trimethoxy-5"-isopropenyl-4",5"-dihydrofurano[2,3:7,6]flavone

> <FORMULA>
C23H22O7

> <MASS>
410.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DOLRPGHVVKBWMY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C23H22O7/c1-11(2)15-9-13-16(29-15)10-18-19(20(13)24)21(25)23(28-5)22(30-18)12-6-7-14(26-3)17(8-12)27-4/h6-8,10,15,24H,1,9H2,2-5H3

> <SMILES>
C12OC(C(=C)C)CC1=C(O)C1C(=O)C(OC)=C(C3C=C(OC)C(OC)=CC=3)OC=1C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15126641

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 16383

> <CITATION>
-

$$$$