LMPK12110899
  LIPID_MAPS_STRUCTURE_DATABASE

 37 39  0  0  0  0  0  0  0  0999 V2000
    8.7203    8.6249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7203    7.6007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6074    7.0885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4945    7.6007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4945    8.6249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6074    9.1371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3814    7.0885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2686    7.6007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2686    8.6249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3814    9.1371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3814    6.2898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1552    9.1369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0591    8.6149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9632    9.1369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9632   10.1807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0591   10.7026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1552   10.1807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6074    6.2474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6074   10.1613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7642   10.6432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7207   10.6732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7207   11.6971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6074   12.2089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3860   10.6248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8340   12.2089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8340   13.2328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9473   13.7449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9473   14.7687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8340   15.2807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   15.2807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1552    7.0886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0419    7.6007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9223    7.0822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9135    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8114    7.5856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9725    9.0566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2990    8.6680    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
  3 18  1  0  0  0  0
  6 19  1  0  0  0  0
 20 15  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 17 24  1  0  0  0  0
 22 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
  8 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
  1 36  1  0  0  0  0
 36 37  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110899

> <COMMON_NAME>
Brosimone H

> <SYSTEMATIC_NAME>


> <FORMULA>
C31H36O6

> <MASS>
504.25

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HLKOYMOJPUHOBW-RGVLZGJSSA-N

> <INCHI>
InChI=1S/C31H36O6/c1-18(2)8-7-9-20(5)11-14-23-27(36-6)17-26(34)28-29(35)24(13-10-19(3)4)30(37-31(23)28)22-15-12-21(32)16-25(22)33/h8,10-12,15-17,32-34H,7,9,13-14H2,1-6H3/b20-11+

> <SMILES>
C1(OC)=C(C/C=C(/CC/C=C(/C)\C)\C)C2OC(C3C(O)=CC(O)=CC=3)=C(C/C=C(/C)\C)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
190090

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258293

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 241869

> <CITATION>
-

$$$$