LMPK12130033
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0  0  0  0  0  0  0  0999 V2000
   13.3408    7.7456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3408    8.7488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4720    9.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6031    8.7488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6031    7.7456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4720    7.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2949    7.4356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8847    8.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2949    9.0588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7342    9.2504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6237    8.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1028    8.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6053    7.3768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6102    7.3768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1126    8.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6102    9.1175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6053    9.1175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1158    8.2471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5365    6.5343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1117    9.9862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4718    6.2408    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8915    7.2930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2748    6.1780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5059    7.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0387    9.1141    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6534    8.2853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9285    8.6931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0071    7.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1960    7.1566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3118    7.5781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2331    8.5567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3486    8.9783    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
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  4 10  1  0  0  0  0
  8 11  2  0  0  0  0
 11 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
 15 18  1  0  0  0  0
  7 19  2  0  0  0  0
 16 20  1  0  0  0  0
  6 21  1  0  0  0  0
 26 32  1  0     0  0
 31 25  1  0     0  0
 25 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  1     0  0
 27 10  1  1     0  0
 28 22  1  6     0  0
 29 23  1  1     0  0
 30 24  1  6     0  0
M  END
> <LM_ID>
LMPK12130033

> <COMMON_NAME>
Aureusin

> <SYSTEMATIC_NAME>
2-[(3,4-Dihydroxyphenyl)methylene]-6-(beta-D-glucopyranosyloxy)-4-hydroxy-3(2H)-benzofuranone

> <FORMULA>
C21H20O11

> <MASS>
448.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Aurone flavonoids [PK1213]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AMJCTDBATIKENQ-CMWLGVBASA-N

> <INCHI>
InChI=1S/C21H20O11/c22-7-15-18(27)19(28)20(29)21(32-15)30-9-5-12(25)16-13(6-9)31-14(17(16)26)4-8-1-2-10(23)11(24)3-8/h1-6,15,18-25,27-29H,7H2/t15-,18-,19+,20-,21-/m1/s1

> <SMILES>
C12C(=O)C(=CC3C=C(O)C(O)=CC=3)OC=1C=C(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C=C2O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
114768

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 4150

> <CITATION>
-

$$$$