LMPK12120085
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
   14.0883    8.8382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0883    7.8460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9475    7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8067    7.8460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8067    8.8382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9475    9.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1469    7.8460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0060    7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2881    7.3502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4217    7.8654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2881    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4217    8.8511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5682    9.3438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7145    8.8511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7145    7.8654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5682    7.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5682    6.3871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8612    9.3394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8612    7.3727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0097    7.8643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6659    7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5252    7.8460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5252    8.8382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6659    9.3343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2922    9.6052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5226    8.5709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9475   10.3259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0097    8.8511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4910    9.7494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.8511    0.0000 C   0  0  0  0  0  0  0  0  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
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  2  8  1  0  0  0  0
 10 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 10  1  0  0  0  0
 16 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 19 20  2  0  0  0  0
  4 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24  5  1  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
  6 27  1  0  0  0  0
 18 28  1  0  0  0  0
 28 20  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120085

> <COMMON_NAME>
Glyinflanin G

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H24O5

> <MASS>
404.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JIQHAMDPLDKKBS-FNORWQNLSA-N

> <INCHI>
InChI=1S/C25H24O5/c1-24(2)12-10-18-21(29-24)8-6-17(22(18)28)19(26)7-5-15-13-16-9-11-25(3,4)30-23(16)20(27)14-15/h5-14,27-28H,1-4H3/b7-5+

> <SMILES>
C1=C(O)C2OC(C)(C)C=CC=2C=C1/C=C/C(=O)C1C(O)=C2C=CC(C)(C)OC2=CC=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15233561

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74614

> <CITATION>
-

$$$$