KEGG   COMPOUND: C06162Help
Entry
C06162                      Compound                               

Name
Sanguinarine
Formula
C20H14NO4
Exact mass
332.0923
Mol weight
332.3295
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Isoquinoline alkaloid biosynthesis
Enzyme
1.3.1.107       1.3.3.8         1.5.3.12
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C06162  Sanguinarine
Natural toxins [BR:br08009]
 Phytotoxins
  Alkaloids
   Isoquinoline alkaloids
    C06162  Sanguinarine
BRITE hierarchy
Other DBs
CAS: 
2447-54-3
PubChem: 
ChEBI: 
ChEMBL: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C8x C    19.6000   -8.4000
            2   C8y C    19.6000   -9.8000
            3   C8y C    20.8124  -10.5000
            4   C8y C    22.0249   -9.8000
            5   C8y C    22.0249   -8.4000
            6   C8x C    20.8124   -7.7000
            7   C8x C    23.2373  -10.5000
            8   N5y N    24.4497   -9.8000 #+
            9   C8y C    24.4497   -8.4000
            10  C8y C    23.2373   -7.7000
            11  C8y C    25.6622   -7.7000
            12  C8y C    25.6622   -6.3000
            13  C8x C    24.4497   -5.6000
            14  C8x C    23.2373   -6.3000
            15  C8x C    26.8746   -8.4000
            16  C8y C    28.0870   -7.7000
            17  C8y C    28.0870   -6.3000
            18  C8x C    26.8746   -5.6000
            19  O2x O    18.5596  -10.7368
            20  C1x C    19.1290  -12.0158
            21  O2x O    20.5214  -11.8694
            22  O2x O    29.4185   -8.1326
            23  C1x C    30.2414   -7.0000
            24  O2x O    29.4185   -5.8674
            25  C1a C    25.6473  -10.4915
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    9  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   10  14 1
            17   11  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21   12  18 1
            22    2  19 1
            23   19  20 1
            24   20  21 1
            25    3  21 1
            26   16  22 1
            27   22  23 1
            28   23  24 1
            29   17  24 1
            30    8  25 1

» Japanese version

DBGET integrated database retrieval system