KEGG   COMPOUND: C10486
Entry
C10486                      Compound                               
Name
Licoisoflavone A;
2',4',5,7-Tetrahydroxy-3'-(3,3-dimethylallyl)isoflavone
Formula
C20H18O6
Exact mass
354.1103
Mol weight
354.3533
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1205 Isoflavonoids
    C10486  Licoisoflavone A
Phytochemical compounds [BR:br08003]
 Flavonoids
  Isoflavonoids
   Isoflavones
    C10486  Licoisoflavone A
Other DBs
CAS: 66056-19-7
PubChem: 12669
ChEBI: 28620
LIPIDMAPS: LMPK12050286
KNApSAcK: C00002542
PDB-CCD: JU3[PDBj]
3DMET: B03891
NIKKAJI: J18.970G
KCF data

ATOM        26
            1   C8y C    24.1275  -16.9577
            2   C8y C    25.3396  -17.6627
            3   C8y C    22.9097  -17.6512
            4   C8x C    24.1334  -15.5593
            5   C8y C    26.5514  -16.9694
            6   C8x C    25.3279  -19.0611
            7   C8y C    21.6978  -16.9460
            8   O5x O    22.9040  -19.0494
            9   O2x O    22.9214  -14.8484
            10  C8y C    27.7635  -17.6686
            11  O1a O    26.5514  -15.5652
            12  C8x C    26.5398  -19.7720
            13  C8y C    21.7036  -15.5476
            14  C8y C    20.5034  -17.6453
            15  C8y C    27.7576  -19.0727
            16  C1b C    28.9754  -16.9753
            17  C8x C    20.5034  -14.8427
            18  C8x C    19.2856  -16.9460
            19  O1a O    20.5034  -19.0437
            20  O1a O    28.9637  -19.7779
            21  C2b C    30.1815  -17.6802
            22  C8y C    19.2856  -15.5476
            23  C2c C    31.3993  -16.9868
            24  O1a O    18.0737  -14.8427
            25  C1a C    32.6112  -17.6919
            26  C1a C    31.4050  -15.5885
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 2
            10    5  11 1
            11    6  12 1
            12    7  13 2
            13    7  14 1
            14   10  15 1
            15   10  16 1
            16   13  17 1
            17   14  18 2
            18   14  19 1
            19   15  20 1
            20   16  21 1
            21   17  22 2
            22   21  23 2
            23   22  24 1
            24   23  25 1
            25   23  26 1
            26    9  13 1
            27   12  15 2
            28   18  22 1

» Japanese version

  All links  
Chemical substance (8)   
   PubChem (1)   
   ChEBI (1)   
   3DMET (1)   
   HMDB (1)   
   KNApSAcK (1)   
   LIPIDMAPS (1)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (8)   

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