LMPK12110860
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
   13.2389    8.3889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2389    7.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0150    6.9739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7909    7.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7909    8.3180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0150    8.7660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5669    6.9739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3430    7.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3430    8.3180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5669    8.7660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5669    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1338    8.7746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9247    8.3180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7156    8.7746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7156    9.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9247   10.1443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1338    9.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0150    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4477    8.8842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5064   10.1443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5064    8.3180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.9247   11.0575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5064    7.6656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4514   11.3618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4347    7.1580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4331    7.1723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4490    8.9100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9525    9.7616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4765   10.4640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4492    8.8899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9427    8.0269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9394    8.0354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4475    8.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9540    9.7672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4620   10.6361    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
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  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 12  1  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 20 15  1  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 29 35  1  0     0  0
 34 28  1  0     0  0
 28 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  0     0  0
 34 35  1  1     0  0
 30 19  1  1     0  0
 31 25  1  6     0  0
 32 26  1  1     0  0
 33 27  1  6     0  0
M  END
> <LM_ID>
LMPK12110860

> <COMMON_NAME>
Tricin 7-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H24O12

> <MASS>
492.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JGXFMIJHKASCIZ-LDBVRRDLSA-N

> <INCHI>
InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
131776

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5322022

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$