LMPK12140464
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0  0  0  0  0  0  0  0999 V2000
    9.4575    8.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4575    7.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3068    7.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1561    7.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1561    8.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3068    9.0025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0053    7.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8545    7.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8545    8.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0053    9.0025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7037    9.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5692    8.5026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4347    9.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4347   10.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5692   10.5014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7037   10.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0053    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3068    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2840   10.4921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6083    7.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7591    7.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7591    8.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6083    9.0023    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9098    7.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.5316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9098    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9098    9.0025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9098    9.9831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7591   10.4735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.4735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8545   10.4921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8545   12.0189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 31 32  1  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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  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
  3 18  1  0  0  0  0
 19 14  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 23  1  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 22 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
 16 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140464

> <COMMON_NAME>
Isokurarinone

> <SYSTEMATIC_NAME>
2,3-Dihydro-5,7-dihydroxy-2-(4-hydroxy-2-methoxyphenyl)-8-[5-methyl-2-(1-methylvinyl)-4-hexenyl]-4H-1-benzopyran-4-one

> <FORMULA>
C26H30O6

> <MASS>
438.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HBGUTBHLNQISCQ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C26H30O6/c1-14(2)6-7-16(15(3)4)10-19-20(28)12-24-25(26(19)30)21(29)13-23(32-24)18-9-8-17(27)11-22(18)31-5/h6,8-9,11-12,16,23,27-28,30H,3,7,10,13H2,1-2,4-5H3

> <SMILES>
C1(O)=CC2OC(C3C(OC)=CC(O)=CC=3)CC(=O)C=2C(O)=C1CC(C(C)=C)C/C=C(/C)\C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13872451

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 49840

> <CITATION>
4783169

$$$$