LMPK12050216
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0     0  0            999 V2000
    8.6273   10.0123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6273    9.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4829    8.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3384    9.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3384   10.0123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4829   10.5063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1941    8.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0497    9.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0497   10.0123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1941   10.5063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9054    8.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9054    7.4742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8201    6.9461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7349    7.4742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7349    8.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8201    9.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1941    7.5424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4829    7.5424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7718    8.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7718    7.5424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9161    7.0486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9161    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.5424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4829   11.4942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6273   11.9883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7718   11.4942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7718   10.5063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2777   12.3498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7839   11.4942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5904    6.9801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6273    7.0486    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
  3 18  1  0  0  0  0
  2 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
  6 24  1  0  0  0  0
 24 25  2  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
 26 29  1  0  0  0  0
 30 14  1  0  0  0  0
 20 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050216

> <COMMON_NAME>
Euchrenone b9

> <SYSTEMATIC_NAME>
3-(4-Hydroxyphenyl)-5-hydroxy-6-(2-hydroxy-3-methyl-3-butenyl)-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one

> <FORMULA>
C25H24O6

> <MASS>
420.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KOYTWDRAYNCQMX-UHFFFAOYSA-N

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

> <SMILES>
C12OC(C)(C)C=CC=1C1OC=C(C3=CC=C(O)C=C3)C(=O)C=1C(O)=C2CC(O)C(=C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
178574

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14704593

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53879

> <CITATION>
-

$$$$