LMPK12112503
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0     0  0            999 V2000
    8.4476    9.8158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3571   10.3408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3571   11.3910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4476   11.9160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5382   11.3910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5382   10.3408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2664    9.8158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1757   10.3408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1757   11.3910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2664   11.9160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1943   11.9790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1001   11.4561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0058   11.9790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0058   13.0248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1001   13.5477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1943   13.0248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1001   14.4318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8916   13.5362    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8426   12.9871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8266   11.5052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9800    9.8766    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.8560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4476    9.0660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2664    9.0015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7061    8.8636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6918    6.8620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9541    5.8779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1025    8.3813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9742    8.8781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8372    8.3716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8287    7.3683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9599    6.8764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0969    7.3829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2280    6.8909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0852    5.3830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0794    4.3830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2221    5.8880    0.0000 C   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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  3  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 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 11  1  0  0  0  0
 15 17  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 13 20  1  0  0  0  0
  8 21  1  0  0  0  0
  5 22  1  0  0  0  0
  1 23  1  0  0  0  0
  7 24  2  0  0  0  0
 33 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  0     0  0
 33 34  1  6     0  0
 29 21  1  1     0  0
 30 25  1  6     0  0
 31 26  1  6     0  0
 32 27  1  1     0  0
 27 35  1  0     0  0
 35 36  2  0     0  0
 35 37  1  0     0  0
M  END
> <LM_ID>
LMPK12112503

> <COMMON_NAME>
Mearnsetin 3-O-(4''-O-acetyl)-alpha-L-rhamnopyranoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C24H24O13

> <MASS>
520.12

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SQTSPIMCWRYNFT-OZKUPCRYSA-N

> <INCHI>
InChI=1S/C24H24O13/c1-8-20(35-9(2)25)18(31)19(32)24(34-8)37-23-17(30)16-12(27)6-11(26)7-15(16)36-21(23)10-4-13(28)22(33-3)14(29)5-10/h4-8,18-20,24,26-29,31-32H,1-3H3/t8-,18-,19+,20-,24-/m0/s1

> <SMILES>
C1(O)C=C(O)C=C2OC(C3C=C(O)C(OC)=C(O)C=3)=C(O[C@H]3[C@H](O)[C@H](O)[C@@H](OC(C)=O)[C@H](C)O3)C(=O)C=12

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23955895

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$