LMPK12140111
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0  0  0  0  0  0  0  0999 V2000
    7.9165    7.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7488    7.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5812    7.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5812    8.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7488    8.9430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9165    8.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4134    7.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2458    7.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2458    8.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4134    8.9430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0773    8.9425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4134    6.1836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9314    8.4496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7851    8.9425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7851    9.9285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9314   10.4216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0773    9.9285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0848    8.9425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7488    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7488   10.8919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8778   11.3948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8778   12.4470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9682   12.9721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1198   10.9572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3624   11.3944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1198   10.0827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2248   10.4206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9314    7.4652    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9682   14.0202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   14.5441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8759   14.5441    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
  3  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  4  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 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 17  2  0  0  0  0
 17 11  1  0  0  0  0
  6 18  1  0  0  0  0
  2 19  1  0  0  0  0
  5 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  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
 17 27  1  0  0  0  0
 13 28  1  0  0  0  0
 23 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140111

> <COMMON_NAME>
Exiguaflavanone A

> <SYSTEMATIC_NAME>
(2S)-2',5,6',7-Tetrahydroxy-8-(2-isopropenyl-5-methyl-4-hexenyl)flavanone

> <FORMULA>
C25H28O6

> <MASS>
424.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FPUREMWTZVLZBZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H28O6/c1-13(2)8-9-15(14(3)4)10-16-19(28)11-20(29)24-21(30)12-22(31-25(16)24)23-17(26)6-5-7-18(23)27/h5-8,11,15,22,26-29H,3,9-10,12H2,1-2,4H3

> <SMILES>
C1C(O)=C(CC(C(C)=C)C/C=C(\C)/C)C2OC(C3C(O)=CC=CC=3O)CC(=O)C=2C=1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10070990

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2981873

> <CITATION>
-

$$$$