LMPK12111523
  LIPID_MAPS_STRUCTURE_DATABASE

 33 37  0  0  0  0  0  0  0  0999 V2000
    7.8394    6.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8394    7.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1296    7.4590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1296    5.8197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5493    5.8197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2592    6.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2592    7.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5493    7.4590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5493    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4198    6.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4198    7.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1296    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9690    5.8197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6789    6.2295    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.6789    7.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9690    7.4590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3888    7.4590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3888    8.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6789    8.6885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9690    8.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9552    7.1320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9577    6.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0986    8.6885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7099    7.4590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9577    5.4098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7770    6.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2592    8.6885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6625    9.6996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4310   10.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1096    9.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7239   10.1062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1096    9.2236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.0492    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 11  2  0  0  0  0
 10  4  2  0  0  0  0
  4  1  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  2  1  0  0  0  0
  5  9  2  0  0  0  0
 11 10  1  0  0  0  0
  4 12  1  0  0  0  0
  6 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16  7  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 16  1  0  0  0  0
 11 24  1  0  0  0  0
 20 27  1  0  0  0  0
 18 23  1  0  0  0  0
 17 21  1  0  0  0  0
 14 22  1  0  0  0  0
 22 21  1  0  0  0  0
 22 25  1  0  0  0  0
 22 26  1  0  0  0  0
 19 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 24 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111523

> <COMMON_NAME>
Artonin T

> <SYSTEMATIC_NAME>


> <FORMULA>
C26H26O7

> <MASS>
450.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WGHQJSXSGKUCQL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C26H26O7/c1-11(2)6-7-13-21(28)20-18-15(26(3,4)33-25(18)23(13)30)10-14-22(29)19-16(27)8-12(31-5)9-17(19)32-24(14)20/h6,8-9,15,27-28,30H,7,10H2,1-5H3

> <SMILES>
C12C(=O)C3CC4C(C)(C)OC5=C(O)C(C/C=C(\C)/C)=C(O)C(C=3OC=1C=C(OC)C=C2O)=C45

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0029905

> <CHEBI_ID>
176137

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258664

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$