LMPK12110247
  LIPID_MAPS_STRUCTURE_DATABASE

 39 43  0     0  0            999 V2000
    9.5999   -3.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5999   -4.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4833   -4.5682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3667   -4.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3667   -3.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4833   -2.5281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2503   -4.5682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1336   -4.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1336   -3.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2503   -2.5281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2503   -5.3636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4833   -5.5881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2132   -2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1443   -2.9020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0751   -2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0751   -1.2896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1443   -0.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2132   -1.2896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0054   -0.7525    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7169   -2.5282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5192   -6.0954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7857   -7.0962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0575   -6.0956    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7855   -4.0940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6551   -4.5944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6551   -5.5950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7855   -6.0956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9216   -5.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9216   -4.5945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3950   -6.7932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7285   -8.7669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1881  -10.0378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9147   -7.7203    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6869   -7.0798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6248   -7.4287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7907   -8.4182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0204   -9.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0826   -8.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3123   -9.3400    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
  3 12  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
  9 13  1  0  0  0  0
 16 19  1  0  0  0  0
  1 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  6     0  0
 25  2  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
M  END
> <LM_ID>
LMPK12110247

> <COMMON_NAME>
Cerarvensin 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>
VAVQNLQUQMOVEY-ULLRLSHTSA-N

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

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H](O)[C@H](O)CO1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101644262

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$