LMPK12111889
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0  0  0  0  0  0  0  0999 V2000
    7.5591   12.4036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5591   11.4359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3970   10.9519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2352   11.4359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2352   12.4036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3970   12.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0732   10.9519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9111   11.4359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9111   12.4036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0732   12.8873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0732   10.1976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9663   13.0736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8204   12.5803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6745   13.0736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6745   14.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8204   14.5528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9663   14.0599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3970    9.9847    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8702   14.6313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8134   12.8873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7597   10.8189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5065    9.7939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4922    7.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7336    6.7723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8718    9.3058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7538    9.8085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6272    9.2960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6187    8.2806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7395    7.7828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8661    8.2953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9868    7.7975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8543    6.2714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4851    6.7562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3579    6.2442    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6051    6.2563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8484    5.2594    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9807    6.7825    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
  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
 20  1  1  0  0  0  0
 21  8  1  0  0  0  0
  4  3  1  0  0  0  0
 30 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  6     0  0
 26 21  1  1     0  0
 27 22  1  6     0  0
 28 23  1  6     0  0
 29 24  1  1     0  0
 24 32  1  0     0  0
 23 33  1  0     0  0
 33 34  2  0     0  0
 33 35  1  0     0  0
 32 36  2  0     0  0
 32 37  1  0     0  0
M  END
> <LM_ID>
LMPK12111889

> <COMMON_NAME>
Kaempferol 3-(3'',4''-diacetylrhamnoside)

> <SYSTEMATIC_NAME>
3,5,7,4'-Tetrahydroxyflavone 3- (3",4"-diacetylrhamnoside)

> <FORMULA>
C25H24O12

> <MASS>
516.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SXOZSDJHGMAEGZ-IGKKHSBFSA-N

> <INCHI>
InChI=1S/C25H24O12/c1-10-21(34-11(2)26)24(35-12(3)27)20(32)25(33-10)37-23-19(31)18-16(30)8-15(29)9-17(18)36-22(23)13-4-6-14(28)7-5-13/h4-10,20-21,24-25,28-30,32H,1-3H3/t10-,20+,21-,24-,25-/m0/s1

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](C)O3)C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10459196

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 311405

> <CITATION>
-

$$$$