KEGG   COMPOUND: C10566Help
Entry
C10566                      Compound                               

Name
Alchorneine
Formula
C12H19N3O
Exact mass
221.1528
Mol weight
221.2988
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 28340-21-8
PubChem: 12749
ChEBI: 2551
KNApSAcK: C00002311
3DMET: B03963
NIKKAJI: J17.039I
LinkDB All DBs
KCF data Show

ATOM        16
            1   C2y C    27.7501  -19.7405
            2   N1y N    29.0191  -19.2454
            3   N1y N    27.7442  -21.1434
            4   N2x N    26.5391  -19.0419
            5   C1y C    29.9042  -20.4507
            6   O2a O    29.0715  -17.9124
            7   C1x C    29.0774  -21.5800
            8   C2x C    26.5391  -21.8420
            9   C1z C    25.3225  -19.7405
            10  C2c C    31.2955  -20.4507
            11  C1a C    30.2825  -17.1964
            12  C2x C    25.3225  -21.1375
            13  C1a C    24.1058  -20.4332
            14  C1a C    25.3166  -18.3374
            15  C1a C    31.9941  -21.6499
            16  C2a C    31.9941  -19.2340
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1 #Down
            10    6  11 1
            11    8  12 2
            12    9  13 1
            13    9  14 1
            14   10  15 1
            15   10  16 2
            16    5   7 1
            17    9  12 1

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