LMPK12110235
  LIPID_MAPS_STRUCTURE_DATABASE

 39 43  0  0  0  0  0  0  0  0999 V2000
    9.8008    8.7829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8008    7.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6692    7.2785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5377    7.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5377    8.7829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6692    9.2843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4062    7.2785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2748    7.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2748    8.7829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4062    9.2843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4062    6.4966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9325    9.2841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6692    6.2760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2393    9.3163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1545    8.7879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0698    9.3163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0698   10.3730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1545   10.9012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2393   10.3730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9842   10.9009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9894   10.2327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9895   12.2080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6973   13.1911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5549   10.7270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6984   10.2307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8432   10.7243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8447   11.7144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6984   12.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5535   11.7121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7094    8.7291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7669    9.0860    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1084   10.9430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6869   11.3417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0202   10.4094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3802    9.6577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4068    9.8378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0777   10.7663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7177   11.5182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3884   12.4467    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
  1 12  1  0  0  0  0
  3 13  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 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 14  9  1  0  0  0  0
 17 20  1  0  0  0  0
 29 24  1  0     0  0
 24 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
 26 21  1  6     0  0
 27 22  1  1     0  0
 28 23  1  1     0  0
 38 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  6     0  0
 34 21  1  1     0  0
 35 30  1  6     0  0
 36 31  1  6     0  0
 37 32  1  1     0  0
 25  6  1  1     0  0
M  END
> <LM_ID>
LMPK12110235

> <COMMON_NAME>
Mollupentin 2''-O-rhamnoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C26H28O13

> <MASS>
548.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LLZRWOGJPVYDHM-CZCDDCDDSA-N

> <INCHI>
InChI=1S/C26H28O13/c1-9-19(32)21(34)22(35)26(37-9)39-25-20(33)15(31)8-36-24(25)18-13(29)6-12(28)17-14(30)7-16(38-23(17)18)10-2-4-11(27)5-3-10/h2-7,9,15,19-22,24-29,31-35H,8H2,1H3/t9-,15-,19-,20-,21+,22+,24-,25+,26-/m0/s1

> <SMILES>
C1(O)=C([C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@@H](O)CO2)C2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101644263

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 549436

> <CITATION>
-

$$$$