LMPK12112717
  LIPID_MAPS_STRUCTURE_DATABASE

 29 32  0  0  0  0  0  0  0  0999 V2000
    9.0534    8.8227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0534    7.8378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9064    7.3452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7595    7.8378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7595    8.8227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9064    9.3153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6125    7.3452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4656    7.8378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4656    8.8227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6125    9.3153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6125    6.5773    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3183    9.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1877    8.8132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0572    9.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0572   10.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1877   10.8208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3183   10.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9264   10.8207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9064    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1166    9.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5376    8.3303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1166    7.5333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5530    8.3303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1877   11.8245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9064   10.2999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7936    7.0710    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6465    7.5636    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
 15 18  1  0  0  0  0
  3 19  1  0  0  0  0
  1 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  2  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
 16 26  1  0  0  0  0
  6 27  1  0  0  0  0
  8 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112717

> <COMMON_NAME>
8-C-Methylvelloquercetin 3-methyl ether

> <SYSTEMATIC_NAME>
5,3',4'-Trihydroxy-3-methoxy-8-methyl-5"-isopropenyl-4",5"-dihydrofurano[2,3:7,6]flavone

> <FORMULA>
C22H20O7

> <MASS>
396.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CHZNUCAJDKMYOD-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H20O7/c1-9(2)15-8-12-17(25)16-18(26)22(27-4)21(11-5-6-13(23)14(24)7-11)29-20(16)10(3)19(12)28-15/h5-7,15,23-25H,1,8H2,2-4H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259675

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 16383

> <CITATION>
-

$$$$