KEGG   COMPOUND: C10614
Entry
C10614                      Compound                               
Name
Securinine
Formula
C13H15NO2
Exact mass
217.1103
Mol weight
217.2637
Structure
Other DBs
CAS: 5610-40-2
PubChem: 12797
ChEBI: 9079
KNApSAcK: C00002360
3DMET: B03997
NIKKAJI: J9.556G
LinkDB
KCF data

ATOM        16
            1   C2y C    30.2154  -20.0421
            2   C2x C    30.6433  -18.7279
            3   C7x C    29.5167  -17.9104
            4   O7x O    28.3971  -18.7279
            5   C1z C    28.8250  -20.0421
            6   O6a O    29.5167  -16.5269
            7   C1x C    25.0276  -20.4654
            8   C1x C    25.0276  -21.8489
            9   C1x C    26.2268  -22.5405
            10  C1x C    26.2268  -19.7738
            11  C1y C    27.4188  -20.4654
            12  N1y N    27.4204  -21.8499
            13  C1y C    28.7439  -22.2736
            14  C2x C    30.1443  -22.2824
            15  C2x C    30.9757  -21.2313
            16  C1x C    29.5453  -21.1547
BOND        19
            1     7   8 1
            2     8   9 1
            3     9  12 1
            4    11  10 1
            5    10   7 1
            6     5   1 1
            7     3   6 2
            8    11  12 1
            9    12  13 1
            10    5  11 1
            11    1   2 2
            12   13  14 1
            13    2   3 1
            14    1  15 1
            15   14  15 2
            16    5  16 1 #Down
            17    3   4 1
            18   13  16 1 #Down
            19    4   5 1

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