LMPK12140537
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.7227    9.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7227    8.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6310    7.4770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5391    8.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5391    9.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6310    9.5744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4472    7.4770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3554    8.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3554    9.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4472    9.5744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3195    9.6067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2275    9.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1358    9.6067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1358   10.6554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2275   11.1798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3195   10.6554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4472    6.5543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6310    6.5534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8825    9.5352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9359   11.1174    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7774    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5965   10.7360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9366    9.1443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7630    9.6215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2275    8.1684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9450    7.7542    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
  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
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
 14 21  1  0  0  0  0
 18 22  1  0  0  0  0
 21 23  1  0  0  0  0
 13 24  1  0  0  0  0
 24 25  1  0  0  0  0
 12 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140537

> <COMMON_NAME>
5,7,2',3',4'-Pentamethoxyflavanone

> <SYSTEMATIC_NAME>
5,7,2',3',4'-Pentamethoxyflavanone

> <FORMULA>
C20H22O7

> <MASS>
374.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HZWSAUOBLMSNPL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H22O7/c1-22-11-8-16(24-3)18-13(21)10-15(27-17(18)9-11)12-6-7-14(23-2)20(26-5)19(12)25-4/h6-9,15H,10H2,1-5H3

> <SMILES>
C1(OC)C=C2OC(C3C=CC(OC)=C(OC)C=3OC)CC(=O)C2=C(OC)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21573556

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2566155

> <CITATION>
12608871

$$$$