LMPK12140509
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0            999 V2000
    9.8378   -6.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8378   -7.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7097   -7.8580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5816   -7.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5816   -6.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7097   -5.8446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4535   -7.8580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3254   -7.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3254   -6.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4535   -5.8446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1970   -5.8447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0855   -6.3578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9741   -5.8447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9741   -4.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0855   -4.3057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1970   -4.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4535   -8.7104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7097   -8.8646    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3085   -4.3058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9663   -7.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0947   -7.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2250   -7.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3551   -7.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2250   -8.8612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7097   -4.8379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8378   -4.3345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9658   -4.8379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9658   -5.8446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7253   -3.9404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1384   -5.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8628   -4.3057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7347   -4.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
  9 11  1  6     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 11  1  0     0  0
  7 17  2  0     0  0
  3 18  1  0     0  0
 16 19  1  0     0  0
  2 20  1  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 22 24  1  0     0  0
  6 25  1  0     0  0
 25 26  2  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28  1  1  0     0  0
 27 29  1  0     0  0
 27 30  1  0     0  0
 14 31  1  0     0  0
 31 32  1  0     0  0
M  END
> <LM_ID>
LMPK12140509

> <COMMON_NAME>
Fleminone

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

> <FORMULA>
C26H28O6

> <MASS>
436.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BCGZYQZPALWTAY-NRFANRHFSA-N

> <INCHI>
InChI=1S/C26H28O6/c1-14(2)6-8-17-23(29)22-20(28)13-21(16-9-7-15(30-5)12-19(16)27)31-25(22)18-10-11-26(3,4)32-24(17)18/h6-7,9-12,21,27,29H,8,13H2,1-5H3/t21-/m0/s1

> <SMILES>
C12OC(C)(C)C=CC=1C1O[C@H](C3C(O)=CC(OC)=CC=3)CC(=O)C=1C(O)=C2C/C=C(\C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101326868

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 520843

> <CITATION>
-

$$$$