LMPK12050178
  LIPID_MAPS_STRUCTURE_DATABASE

 31 35  0     0  0            999 V2000
    8.0283    9.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0283    8.9808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8688    8.4954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7093    8.9808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7093    9.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8688   10.4364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5497    8.4954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3902    8.9808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3902    9.9513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5497   10.4364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2305    8.4955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2305    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1289    6.9392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0276    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0276    8.4955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1289    9.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5497    7.5204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9262    6.9392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8249    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8249    8.4955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9262    9.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8688    7.5254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8249    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8133    8.0286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6669   11.3859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7018   11.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3071   10.6006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2168   12.3274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2485   12.3274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7008   13.1658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   13.1658    0.0000 O   0  0  0  0  0  0  0  0  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
  8 11  1  0  0  0  0
 11 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 11  2  0  0  0  0
  1  2  1  0  0  0  0
  7 17  2  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 15  1  0  0  0  0
  3 22  1  0  0  0  0
 19 23  1  0  0  0  0
 19 24  1  0  0  0  0
  6 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27  1  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 28 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050178

> <COMMON_NAME>
Ulexone C

> <SYSTEMATIC_NAME>
5-Hydroxy-8-(2-hydroxypropan-2-yl)-3-(2,2-dimethyl-2H-1-benzopyran-6-yl)-8,9-dihydro-4H-furo[2,3-h]-1-benzopyran-4-one

> <FORMULA>
C25H24O6

> <MASS>
420.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RHNKNAQMIBBEOO-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O6/c1-24(2)8-7-14-9-13(5-6-18(14)31-24)16-12-29-23-15-10-20(25(3,4)28)30-19(15)11-17(26)21(23)22(16)27/h5-9,11-12,20,26,28H,10H2,1-4H3

> <SMILES>
C12OC(C(O)(C)C)CC=1C1OC=C(C3=CC4C=CC(C)(C)OC=4C=C3)C(=O)C=1C(O)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
178571

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14583602

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3902

> <CITATION>
-

$$$$