LMPK12112282
  LIPID_MAPS_STRUCTURE_DATABASE

 32 36  0  0  0  0  0  0  0  0999 V2000
    8.8402    7.5971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8282    8.6277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7023    7.0911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6093    7.5893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6208    8.6363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7147    9.1534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5135    9.1517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9651    9.1335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0554    8.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0581    7.5707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9346    7.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7023    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5020    7.0739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4060    8.6363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2987    9.1517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2987   10.1824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4060   10.6978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5135   10.1824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9346    6.2567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7665   10.1546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7341   10.2814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    9.3385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3132   11.0102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1670   10.8481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5785    9.9370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0799    8.7007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1913   10.6978    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1913   11.7285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2987   12.2438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4060   11.7285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9603   12.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0403   11.2384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  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  2  1  0  0  0  0
  7  5  1  0  0  0  0
  2  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11  1  2  0  0  0  0
  3 12  2  0  0  0  0
  4 13  1  0  0  0  0
  7 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18  7  1  0  0  0  0
 11 19  1  0  0  0  0
  8 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  9  1  0  0  0  0
 21 23  1  0  0  0  0
 20 24  1  0  0  0  0
 20 25  1  0  0  0  0
 15 26  1  0  0  0  0
 16 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 17  1  0  0  0  0
 28 31  1  0  0  0  0
 28 32  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112282

> <COMMON_NAME>
Broussonol B

> <SYSTEMATIC_NAME>
8,9-Dihydro-3,5-dihydroxy-2-(8-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-8,9,9-trimethyl-4H-furo[2,3-h]-1-benzopyran-4-one

> <FORMULA>
C25H24O7

> <MASS>
436.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WYEJSRSJEMZHNA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O7/c1-11-25(4,5)18-16(30-11)10-14(26)17-19(28)20(29)22(31-23(17)18)13-8-12-6-7-24(2,3)32-21(12)15(27)9-13/h6-11,26-27,29H,1-5H3

> <SMILES>
C12=C(O)C=C3OC(C)C(C)(C)C3=C1OC(C1C=C3C=CC(C)(C)OC3=C(O)C=1)=C(O)C2=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10320815

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 66380

> <CITATION>
11575957

$$$$