LMPK12120387
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0  0  0  0  0  0  0  0999 V2000
    7.7172    8.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7172    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5950    7.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4729    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4729    8.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5950    9.1011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3506    7.0739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2284    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1058    7.0741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9833    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8685    7.0697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7537    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7537    8.6028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8685    9.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9833    8.6028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3506    6.2828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1058    6.0630    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6388    9.1137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5950    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5950   10.1147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7172   10.6213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8395   10.1147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8395    9.1011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1835   10.7707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.6650    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
  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 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  9 17  2  0  0  0  0
 13 18  1  0  0  0  0
  3 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  1  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120387

> <COMMON_NAME>
Glyinflanin B

> <SYSTEMATIC_NAME>
1-(7-Hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3-(4-hydroxyphenyl)-1,3-propanedione

> <FORMULA>
C20H18O5

> <MASS>
338.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KXBWVUQZNQMUBZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H18O5/c1-20(2)8-7-13-9-15(18(24)11-19(13)25-20)17(23)10-16(22)12-3-5-14(21)6-4-12/h3-9,11,21,24H,10H2,1-2H3

> <SMILES>
C12OC(C)(C)C=CC=1C=C(C(=O)CC(=O)C1C=CC(O)=CC=1)C(O)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
480799

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74614

> <CITATION>
-

$$$$