KEGG   COMPOUND: C17899
Entry
C17899                      Compound                               
Name
Isosinomenine
Formula
C19H23NO4
Exact mass
329.1627
Mol weight
329.3902
Structure
Other DBs
PubChem: 96024132
ChEBI: 81369
NIKKAJI: J14.006F
LinkDB
KCF data

ATOM        24
            1   C1y C    29.9315  -21.1666
            2   C1x C    29.9315  -19.8012
            3   C8y C    28.7710  -19.1186
            4   C8y C    27.5422  -19.8012
            5   C1z C    27.5422  -21.1666
            6   C1y C    28.7710  -21.8492
            7   C2x C    26.3817  -21.8492
            8   C2y C    26.3817  -23.2145
            9   C5x C    27.5422  -23.8972
            10  C1x C    28.7710  -23.2145
            11  C8x C    28.7710  -17.7533
            12  C8x C    27.5422  -17.0706
            13  C8y C    26.3817  -17.7533
            14  C8y C    26.3817  -19.1186
            15  O5x O    27.5422  -25.2625
            16  C1x C    28.7710  -20.4839
            17  N1y N    31.0920  -21.8492
            18  C1x C    31.0920  -20.4839
            19  O1a O    25.2212  -19.8012
            20  O2a O    25.2212  -17.0706
            21  C1a C    24.0607  -17.7533
            22  O2a O    25.2212  -23.8972
            23  C1a C    24.0607  -23.2145
            24  C1a C    31.7801  -23.0524
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 1
            11    6  10 1
            12    3  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    4  14 2
            17    9  15 2
            18    5  16 1 #Down
            19    1  17 1 #Down
            20   17  18 1
            21   18  16 1
            22   14  19 1
            23   13  20 1
            24   20  21 1
            25    8  22 1
            26   22  23 1
            27   17  24 1

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