KEGG   COMPOUND: C09423Help
Entry
C09423                      Compound                               

Name
Erysotrine
Formula
C19H23NO3
Exact mass
313.1678
Mol weight
313.3908
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C09423  Erysotrine
BRITE hierarchy
Other DBs
CAS: 
27740-43-8
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   C1z C    26.7666  -16.2862
            2   C8y C    27.7942  -17.7342
            3   N1y N    27.7942  -15.4045
            4   C2y C    25.6165  -15.5855
            5   C1x C    25.5931  -17.9092
            6   C8y C    29.1547  -17.7342
            7   C8x C    27.1170  -18.9135
            8   C1x C    27.3388  -14.2309
            9   C1x C    29.1371  -15.3988
            10  C2x C    25.9901  -14.2077
            11  C2x C    24.2679  -15.5796
            12  C1y C    24.2503  -17.9152
            13  C1x C    29.8203  -16.5664
            14  C8x C    29.8377  -18.9135
            15  C8y C    27.7942  -20.0870
            16  C2x C    23.5847  -16.7416
            17  O2a O    23.5730  -19.0828
            18  C8y C    29.1547  -20.0929
            19  O2a O    27.1229  -21.2548
            20  O2a O    29.8497  -21.3047
            21  C1a C    25.7260  -21.2575
            22  C1a C    22.1761  -19.0799
            23  C1a C    31.2466  -21.3086
BOND        26
            1     1   4 1
            2     1   5 1
            3     2   6 2
            4     2   7 1
            5     3   8 1
            6     3   9 1
            7     4  10 2
            8     4  11 1
            9     5  12 1
            10    6  13 1
            11    6  14 1
            12    7  15 2
            13   11  16 2
            14   12  17 1 #Up
            15   14  18 2
            16   15  19 1
            17    8  10 1
            18    9  13 1
            19   12  16 1
            20   15  18 1
            21   18  20 1
            22    1   2 1 #Down
            23   19  21 1
            24   17  22 1
            25    1   3 1 #Up
            26   20  23 1

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