KEGG   COMPOUND: C09226Help
Entry
C09226                      Compound                               

Name
Mitragynine
Formula
C23H30N2O4
Exact mass
398.2206
Mol weight
398.4953
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
4098-40-2
PubChem: 
ChEBI: 
ChEMBL: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        29
            1   N4x N    25.5105  -19.5599
            2   C8y C    26.2447  -18.3307
            3   C8x C    21.8179  -17.7827
            4   C8x C    21.8198  -19.1523
            5   C8x C    23.0130  -19.8285
            6   C8y C    23.0092  -17.0963
            7   C8y C    24.1884  -17.7795
            8   C8y C    24.1902  -19.1491
            9   C1x C    26.0349  -16.1012
            10  C1x C    27.3952  -15.9407
            11  C8y C    25.4963  -17.3450
            12  N1y N    28.2071  -17.0436
            13  C1y C    27.6736  -18.3488
            14  C1x C    28.5348  -19.4618
            15  C1y C    29.9295  -19.2697
            16  C1y C    30.4630  -17.9716
            17  C1x C    29.6020  -16.8586
            18  C1b C    31.8770  -17.7783
            19  C1a C    32.4243  -16.4550
            20  C2c C    30.8002  -20.3951
            21  C2b C    32.2183  -20.3448
            22  O2a O    32.7444  -19.0846
            23  C1a C    34.1680  -18.9528
            24  C7a C    30.2699  -21.7198
            25  O6a O    28.8532  -21.7114
            26  O7a O    31.1479  -22.8525
            27  C1a C    30.6059  -24.1753
            28  O2a O    22.9952  -15.6610
            29  C1a C    24.2307  -14.9409
BOND        32
            1     6   3 2
            2     7   8 2
            3    12  13 1
            4    13  14 1
            5    14  15 1
            6    15  16 1
            7    16  17 1
            8    17  12 1
            9    16  18 1 #Up
            10   10   9 1
            11   18  19 1
            12    9  11 1
            13   15  20 1 #Up
            14   13   2 1
            15   20  21 2
            16   10  12 1
            17   21  22 1
            18    2   1 1
            19   22  23 1
            20    2  11 2
            21   20  24 1
            22   11   7 1
            23   24  25 2
            24    8   1 1
            25   24  26 1
            26    3   4 1
            27   26  27 1
            28    4   5 2
            29    6  28 1
            30    5   8 1
            31   28  29 1
            32    7   6 1

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