KEGG   COMPOUND: C12242Help
Entry
C12242                      Compound                               

Name
Chelidonine
Formula
C20H19NO5
Exact mass
353.1263
Mol weight
353.3686
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C12242  Chelidonine
Natural toxins [BR:br08009]
 Phytotoxins
  Alkaloids
   Isoquinoline alkaloids
    C12242  Chelidonine
BRITE hierarchy
Other DBs
CAS: 476-32-4
PubChem: 14387
ChEBI: 31389
ChEMBL: CHEMBL496867
KNApSAcK: C00024623
NIKKAJI: J5.974I
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1y C    24.2516  -13.0825
            2   C8y C    23.0418  -13.7789
            3   C1y C    25.4685  -13.8050
            4   C1y C    24.2052  -11.6897
            5   C8y C    23.0156  -15.1740
            6   C8x C    21.8273  -13.0588
            7   C8y C    26.6784  -13.1205
            8   N1y N    25.4566  -15.2096
            9   C1x C    25.4946  -11.0051
            10  C1x C    24.2325  -15.8965
            11  C8x C    20.6055  -13.7670
            12  C8y C    26.7019  -11.7182
            13  C8x C    27.8715  -13.8311
            14  C1a C    26.6735  -15.9085
            15  C8x C    27.9096  -11.0431
            16  C8y C    29.0885  -13.1371
            17  C8y C    29.1121  -11.7419
            18  O2x O    30.4028  -13.5936
            19  O2x O    30.4410  -11.3427
            20  C1x C    31.2442  -12.4788
            21  C8y C    21.8019  -15.8882
            22  C8y C    20.5937  -15.1716
            23  O2x O    19.5387  -16.0992
            24  C1x C    20.0951  -17.3890
            25  O2x O    21.4937  -17.2586
            26  O1a O    23.0743  -10.9729
BOND        31
            1     3   8 1
            2     4   9 1
            3     5  21 1
            4     5  10 1
            5     6  11 2
            6     7  12 2
            7     7  13 1
            8     8  14 1
            9    12  15 1
            10   13  16 2
            11   15  17 2
            12   16  18 1
            13   17  19 1
            14   18  20 1
            15    8  10 1
            16    9  12 1
            17   11  22 1
            18   16  17 1
            19   19  20 1
            20    1   2 1
            21    1   3 1
            22    1   4 1
            23    2   5 2
            24   21  22 2
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  21 1
            29    4  26 1 #Up
            30    2   6 1
            31    3   7 1

» Japanese version

DBGET integrated database retrieval system