LMPK12112463
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0     0  0            999 V2000
   13.0014   12.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1059   12.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1059   13.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0014   14.1501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8970   13.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8970   12.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2103   12.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3148   12.5989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4193   12.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4193   11.0478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3148   10.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2103   11.0478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5236   12.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6282   12.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6282   11.0478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5236   10.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3148    9.6445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.5989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1059   10.5307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5236    9.6646    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7925   14.1501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0014   15.1841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7468   12.1082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0354    9.9990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5397    8.0619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1159    6.6616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6454    8.8593    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3588    9.5647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3235    9.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5750    8.3275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8630    7.6276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8984    7.8934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1864    7.1933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9991    9.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7121   10.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2498    8.7640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
  9 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 10  1  0  0  0  0
 14 18  1  0  0  0  0
 11 17  2  0  0  0  0
 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
  5 21  1  0  0  0  0
  4 22  1  0  0  0  0
  6 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 19  1  1     0  0
 29 24  1  6     0  0
 30 25  1  6     0  0
 31 26  1  1     0  0
 24 34  1  0     0  0
 34 35  1  0     0  0
 34 36  2  0     0  0
M  END
> <LM_ID>
LMPK12112463

> <COMMON_NAME>
Myricetin 3-(2''-acetylrhamnoside)

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H22O13

> <MASS>
506.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HOTRKBCNUPCEGJ-BKPPBDSASA-N

> <INCHI>
InChI=1S/C23H22O13/c1-7-16(29)19(32)22(34-8(2)24)23(33-7)36-21-18(31)15-11(26)5-10(25)6-14(15)35-20(21)9-3-12(27)17(30)13(28)4-9/h3-7,16,19,22-23,25-30,32H,1-2H3/t7-,16-,19+,22+,23-/m0/s1

> <SMILES>
C1C(O)=C(O)C(O)=CC=1C1=C(O[C@H]2[C@H](OC(=O)C)[C@H](O)[C@@H](O)[C@H](C)O2)C(=O)C2C(O)=CC(O)=CC=2O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101036027

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$