KEGG   COMPOUND: C10647
Entry
C10647                      Compound                               
Name
Balfourodine;
(+)-Balfourodine
Formula
C16H19NO4
Exact mass
289.1314
Mol weight
289.3264
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Quinoline alkaloids
    C10647  Balfourodine
Other DBs
CAS: 484-61-7
PubChem: 12830
ChEBI: 2985
KNApSAcK: C00002140
3DMET: B04026
NIKKAJI: J12.826K
LinkDB
KCF data

ATOM        21
            1   N4y N    25.4329  -18.7656
            2   C8y C    25.4329  -15.9616
            3   C8y C    24.2219  -16.6591
            4   C8y C    24.2279  -18.0610
            5   C8y C    23.0158  -18.7706
            6   C8x C    21.7977  -18.0713
            7   C8x C    21.7917  -16.6694
            8   C8x C    23.0038  -15.9667
            9   C8y C    26.6509  -18.0610
            10  C8y C    26.6517  -16.6658
            11  C1x C    27.9792  -16.2377
            12  C1y C    28.7942  -17.3682
            13  O2x O    27.9778  -18.4908
            14  O5x O    25.4392  -14.5666
            15  O2a O    23.0226  -20.1605
            16  C1a C    25.3761  -20.1676
            17  C1d C    30.2017  -17.3566
            18  C1a C    30.5681  -18.7093
            19  O1a O    31.6037  -17.3495
            20  C1a C    30.9134  -16.1376
            21  C1a C    21.7402  -20.9305
BOND        23
            1     9   1 1
            2     3   4 2
            3     9  10 2
            4    10  11 1
            5    11  12 1
            6    12  13 1
            7    13   9 1
            8     4   5 1
            9     2  14 2
            10    5   6 2
            11    5  15 1
            12    6   7 1
            13    2  10 1
            14    7   8 2
            15    1  16 1
            16    8   3 1
            17   12  17 1 #Down
            18    1   4 1
            19   17  18 1
            20    3   2 1
            21   17  19 1
            22   17  20 1
            23   15  21 1

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