LMPK12140564
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
    7.2780    8.3030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2780    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0098    7.0355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7416    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7416    8.3030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0098    8.7255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4734    7.0355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2051    7.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2051    8.3030    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.4734    8.7255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9366    8.7254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6823    8.2947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4282    8.7254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4282    9.5865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6823   10.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9366    9.5865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4734    6.3203    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2030   10.0339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0098    6.1909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5523    5.9709    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.0050    5.3734    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.6568    5.6269    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2858    5.6338    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8287    6.0909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1628    5.8517    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0000    5.8229    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4490    5.0524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0302    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6488    6.3658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9892    7.6364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5463    8.7255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5463   10.0410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 29 30  1  0  0  0  0
 31 32  1  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  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
 14 18  1  0  0  0  0
  3 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 23 22  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 23 19  1  0  0  0  0
  1 31  1  0  0  0  0
 25 29  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140564

> <COMMON_NAME>
Sakuranin

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H24O10

> <MASS>
448.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NEPMMBQHELYZIW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H24O10/c1-29-12-6-15-18(13(25)8-14(30-15)10-2-4-11(24)5-3-10)16(7-12)31-22-21(28)20(27)19(26)17(9-23)32-22/h2-7,14,17,19-24,26-28H,8-9H2,1H3

> <SMILES>
C1(OC)=CC2OC(C3C=CC(O)=CC=3)CC(=O)C=2C(OC2OC(CO)C(O)C(O)C2O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
348162

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$