LMPK12050423
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0     0  0            999 V2000
    7.5474   10.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5474    9.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3620    9.3017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1768    9.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1768   10.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3620   11.1832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9915    9.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8063    9.7720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8063   10.7128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9915   11.1832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6209    9.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6209    8.2957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4921    7.7928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3631    8.2957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3631    9.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4921    9.8045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9915    8.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3620    8.3608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   11.1832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1779    9.7720    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2242    9.1677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1779    7.8253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1779    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8063    7.8253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8063    6.6168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.3016    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    8.0932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  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
  8 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
  7 17  2  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 15 20  1  0  0  0  0
 14 22  1  0  0  0  0
 12 24  1  0  0  0  0
  2 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050423

> <COMMON_NAME>
Caviunin

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-6,2',4',5'-tetramethoxyisoflavone

> <FORMULA>
C19H18O8

> <MASS>
374.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SHONUJDWRZAHCQ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O8/c1-23-12-7-14(25-3)13(24-2)5-9(12)10-8-27-15-6-11(20)19(26-4)18(22)16(15)17(10)21/h5-8,20,22H,1-4H3

> <SMILES>
C1(O)=CC2OC=C(C3C=C(OC)C(OC)=CC=3OC)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6708635

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53862

> <CITATION>
-

$$$$