LMPK12120388
  LIPID_MAPS_STRUCTURE_DATABASE

 30 32  0  0  0  0  0  0  0  0999 V2000
    7.8085   10.1508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8085    9.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6897    8.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5710    9.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5710   10.1508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6897   10.6596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4524    8.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3336    9.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2146    8.6246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0957    9.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9844    8.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8731    9.1331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8731   10.1594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9844   10.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0957   10.1594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4524    7.8302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2146    7.6094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7615   10.6724    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7615    8.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7615    7.5943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6482    7.0824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6482    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5331    7.5931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6897   11.6772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8085   12.1861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9271   11.6772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9271   10.6596    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4241   12.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607   11.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6897    7.9025    0.0000 O   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  2  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  1  0  0  0  0
 13 18  1  0  0  0  0
 12 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
  6 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27  1  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
  3 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120388

> <COMMON_NAME>
Glyinflanin C

> <SYSTEMATIC_NAME>
4,2',beta-Trihydroxy-6",6"-dimethyl-3-prenylpyrano[2",3":4',5']chalcone

> <FORMULA>
C25H26O5

> <MASS>
406.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KEPOAXFVMYKOPY-BKUYFWCQSA-N

> <INCHI>
InChI=1S/C25H26O5/c1-15(2)5-6-16-11-17(7-8-20(16)26)21(27)13-22(28)19-12-18-9-10-25(3,4)30-24(18)14-23(19)29/h5,7-14,26-27,29H,6H2,1-4H3/b21-13-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42607648

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 74614

> <CITATION>
-

$$$$