LMPK12140348
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0  0  0  0  0  0  0  0999 V2000
    7.6159    8.5805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6387    7.5868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5995    7.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4090    7.6063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4264    8.6260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5293    9.1515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3422    7.0805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1751    7.5760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1636    8.6470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3184    9.1207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0469    9.1570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9012    8.6791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7806    9.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8058   10.1913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9260   10.7225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0355   10.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3422    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.0903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5995    6.0913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6891   10.7012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6637    8.6619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5416    9.1686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4274    8.6572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4274    7.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3093    9.1663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3909   10.2961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9260   11.6519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8653   12.1940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8653   13.1196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1177   13.5514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5715   13.5274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  6  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 14 20  1  0  0  0  0
 13 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 20 26  1  0  0  0  0
 15 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140348

> <COMMON_NAME>
Burttinonedehydrate

> <SYSTEMATIC_NAME>
(S)-5,7-Dihydroxy-4'-methoxy-3'-(3-methylbutadienyl)-5'-(3-methylbut-2-enyl)flavanone

> <FORMULA>
C26H28O5

> <MASS>
420.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NCRSCUAICIRLHP-DRGXBFSJSA-N

> <INCHI>
InChI=1S/C26H28O5/c1-15(2)6-8-17-10-19(11-18(26(17)30-5)9-7-16(3)4)23-14-22(29)25-21(28)12-20(27)13-24(25)31-23/h6-8,10-13,23,27-28H,1,9,14H2,2-5H3/b8-6+/t23-/m0/s1

> <SMILES>
C1(O)C=C2O[C@H](C3C=C(C/C=C(/C)\C)C(OC)=C(/C=C/C(C)=C)C=3)CC(=O)C2=C(O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12098451

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2590687

> <CITATION>
12770595

$$$$