LMPK12113194
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    9.9740    8.9188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9740    7.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8173    7.4584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6605    7.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6605    8.9188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8173    9.4057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5036    7.4584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3470    7.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3470    8.9188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5036    9.4057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1898    9.4056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0832    8.8895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9770    9.4056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9770   10.4374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0832   10.9531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1898   10.4374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8173    6.4853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1373    9.4017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5036    6.4857    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8699   10.9528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8200   10.3689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1898    7.4587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0832   11.9842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7860   10.2055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6273   11.8856    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5031   13.7237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6785   12.1309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2410   11.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2239   11.1245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6443   11.9674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0823   12.8864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0992   12.9681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5371   13.8871    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
  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
  3 17  1  0  0  0  0
  1 18  1  0  0  0  0
  7 19  2  0  0  0  0
 14 20  1  0  0  0  0
 21  6  1  0  0  0  0
  8 22  1  0  0  0  0
 15 23  1  0  0  0  0
 32 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  0     0  0
 31 32  1  0     0  0
 32 33  1  6     0  0
 28 21  1  1     0  0
 29 24  1  6     0  0
 30 25  1  6     0  0
 31 26  1  1     0  0
M  END
> <LM_ID>
LMPK12113194

> <COMMON_NAME>
Gossypetin 8-rhamnoside

> <SYSTEMATIC_NAME>
3,5,7,8,3',4'-Hexahydroxyflavone 8-rhamnoside

> <FORMULA>
C21H20O12

> <MASS>
464.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LXSRQKADIMPZPQ-QBURSZLVSA-N

> <INCHI>
InChI=1S/C21H20O12/c1-6-13(26)15(28)17(30)21(31-6)33-19-11(25)5-10(24)12-14(27)16(29)18(32-20(12)19)7-2-3-8(22)9(23)4-7/h2-6,13,15,17,21-26,28-30H,1H3/t6-,13-,15+,17+,21-/m0/s1

> <SMILES>
C1(O)=C(O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)C2OC(C3C=C(O)C(O)=CC=3)=C(O)C(=O)C=2C(O)=C1

> <KEGG_ID>
C10050

> <HMDB_ID>
-

> <CHEBI_ID>
28086

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281620

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 29729

> <CITATION>
-

$$$$