LMPK12112728
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    7.2126    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2126    6.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9139    6.2608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6153    6.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6153    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9139    7.8805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3167    6.2608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0181    6.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0181    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3167    7.8805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3167    5.4509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7195    7.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4343    7.4679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1492    7.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1492    8.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4343    9.1188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7195    8.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9139    5.4509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5112    7.8805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8098    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8098    6.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5112    6.2608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4048    8.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9139    8.6903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2126    9.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2126    9.9052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5112   10.3102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9139   10.3102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4343    9.9286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8506    9.1109    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7195    6.2608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7195    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 32 33  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 22  2  0  0  0  0
 22  2  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
  6 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 16 30  1  0  0  0  0
 15 31  1  0  0  0  0
  8 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112728

> <COMMON_NAME>
Broussoflavonol A

> <SYSTEMATIC_NAME>


> <FORMULA>
C26H26O7

> <MASS>
450.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TZNGSVFGJAHTSV-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C26H26O7/c1-13(2)6-8-16-23-15(10-11-26(3,4)33-23)20(29)19-21(30)25(31-5)22(32-24(16)19)14-7-9-17(27)18(28)12-14/h6-7,9-12,27-29H,8H2,1-5H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21676157

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$