LMPK12112919
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0     0  0            999 V2000
   11.1720    9.5581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1720    8.5779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0207    8.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8695    8.5779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8695    9.5581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0207   10.0481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7183    8.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5670    8.5779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5670    9.5581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7183   10.0481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7183    7.3238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4155   10.0480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2804    9.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1455   10.0480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1455   11.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2804   11.5462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4155   11.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0207    7.1082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1125   11.6051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3235    8.0881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2804   12.5449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4640    9.9668    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2156    8.2035    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7988    9.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9218    8.6113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6258    6.2124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6520    5.8787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3811    7.4192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6985    8.6926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1381    8.9543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3392    7.9205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9903    6.9825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0007    6.8168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3654    7.5868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7143    8.5248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0788    9.2949    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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  3 18  1  0  0  0  0
 19 15  1  0  0  0  0
  2 20  1  0  0  0  0
 16 21  1  0  0  0  0
  1 22  1  0  0  0  0
  8 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 30 36  1  0     0  0
 35 29  1  0     0  0
 29 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  1     0  0
 31 20  1  1     0  0
 32 26  1  6     0  0
 33 27  1  1     0  0
 34 28  1  1     0  0
M  END
> <LM_ID>
LMPK12112919

> <COMMON_NAME>
Tomentin 6-galactoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H24O13

> <MASS>
508.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QSJCBTMNXPAKKC-LTGKLFRMSA-N

> <INCHI>
InChI=1S/C23H24O13/c1-32-12-6-11-14(16(28)21(12)36-23-19(31)18(30)15(27)13(7-24)35-23)17(29)22(33-2)20(34-11)8-3-4-9(25)10(26)5-8/h3-6,13,15,18-19,23-28,30-31H,7H2,1-2H3/t13-,15+,18+,19-,23+/m1/s1

> <SMILES>
C1(OC)=CC2OC(C3C=C(O)C(O)=CC=3)=C(OC)C(=O)C=2C(O)=C1O[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44259809

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$