LMPK12050106
  LIPID_MAPS_STRUCTURE_DATABASE

 34 38  0     0  0            999 V2000
   10.9099    9.9960    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8352    9.4617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7604    9.9960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6854    9.4620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6854    8.3545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6446    7.8005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6039    8.3545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6039    9.4620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6446   10.0158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8354    8.3940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7604    7.8599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6446    7.0622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5625    7.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5625    6.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4795    6.2126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3966    6.7421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3966    7.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4795    8.3305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4036    6.4147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0260    7.2715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4036    8.1282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0640    7.9485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0641    6.9485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0512    8.1882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0559    8.0280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9241    9.6733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3438   10.7398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8160   11.2238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9146    9.9148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4853    9.0109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4851    8.9319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9194    9.7545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3487   10.6584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7828   11.4811    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  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  6 12  2  0  0  0  0
  7 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 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 17  1  0  0  0  0
 10 22  1  0  0  0  0
 22 23  1  0     0  0
 28 34  1  0     0  0
 33 27  1  0     0  0
 27 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  0     0  0
 33 34  1  1     0  0
 29  1  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
M  END
> <LM_ID>
LMPK12050106

> <COMMON_NAME>
Fujikinetin 7-O-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H22O11

> <MASS>
474.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CJHLOIVYCZZNBR-DODNOZFWSA-N

> <INCHI>
InChI=1S/C23H22O11/c1-29-15-5-11-14(6-17(15)33-23-22(28)21(27)20(26)18(7-24)34-23)30-8-12(19(11)25)10-2-3-13-16(4-10)32-9-31-13/h2-6,8,18,20-24,26-28H,7,9H2,1H3/t18-,20-,21+,22-,23-/m1/s1

> <SMILES>
O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C1C(OC)=CC2C(=O)C(C3C=C4OCOC4=CC=3)=COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101297678

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$