LMPK12112886
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    7.5786    8.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5786    7.8259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4248    7.3373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2710    7.8259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2710    8.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4248    9.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1174    7.3373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9637    7.8259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9637    8.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1174    9.2916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1174    6.5755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8096    9.2915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6719    8.7934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5345    9.2915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5345   10.2872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6719   10.7853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8096   10.2872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.2915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9495    6.9888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3968   10.7851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4248    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6719   11.7808    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7521    7.4581    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0853    8.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4734    5.6917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1119    3.7227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2297    3.0553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8257    5.6685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7041    3.3521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7704    6.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5324    5.3579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3497    4.3713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4088    4.0376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6467    4.6863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7057    4.3525    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
  1 18  1  0  0  0  0
 19  8  1  0  0  0  0
 15 20  1  0  0  0  0
  3 21  1  0  0  0  0
 16 22  1  0  0  0  0
  2 23  1  0  0  0  0
 23 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  1     0  0
M  END
> <LM_ID>
LMPK12112886

> <COMMON_NAME>
Patuletin 3-galactoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H22O13

> <MASS>
494.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AFBZFRQNKMLRPU-UFJVGALSSA-N

> <INCHI>
InChI=1S/C22H22O13/c1-32-20-10(26)5-11-13(15(20)28)16(29)21(19(33-11)7-2-3-8(24)9(25)4-7)35-22-18(31)17(30)14(27)12(6-23)34-22/h2-5,12,14,17-18,22-28,30-31H,6H2,1H3/t12-,14+,17+,18-,22+/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5320434

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$