KEGG   COMPOUND: C04578Help
Entry
C04578                      Compound                               

Name
16-Methoxy-2,3-dihydro-3-hydroxytabersonine
Formula
C22H28N2O4
Exact mass
384.2049
Mol weight
384.4687
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Indole alkaloid biosynthesis
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C04578  16-Methoxy-2,3-dihydro-3-hydroxytabersonine
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        28
            1   C1z C    27.8266  -16.9288
            2   C1y C    28.9727  -16.2524
            3   C1y C    27.8266  -18.2812
            4   C8y C    25.4864  -16.9288
            5   C1x C    26.8519  -15.8320
            6   C1z C    30.1784  -16.9230
            7   N1y N    28.9786  -14.9593
            8   C1z C    29.0090  -18.9635
            9   N1x N    26.6572  -18.9635
            10  C8y C    25.4864  -18.2812
            11  C8x C    24.3169  -16.2640
            12  C1x C    27.5874  -14.7209
            13  C1x C    30.1843  -18.2871
            14  C2x C    31.3539  -16.2350
            15  C1b C    31.3189  -17.5876
            16  C1x C    30.1667  -14.1886
            17  C7a C    29.6550  -20.1096
            18  O1a O    27.9969  -20.7498
            19  C8x C    24.3169  -18.9692
            20  C8x C    23.1649  -16.9288
            21  C2x C    31.3596  -14.8649
            22  C1a C    32.4766  -16.9171
            23  O7a O    30.9957  -20.1155
            24  O6a O    28.9843  -21.2556
            25  C8y C    23.1649  -18.2812
            26  C1a C    31.7305  -21.4132
            27  O2a O    22.0000  -18.9388
            28  C1a C    20.8481  -18.2754
BOND        32
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 2
            10    4  11 1
            11    5  12 1
            12    6  13 1
            13    6  14 1
            14    6  15 1 #Down
            15    7  16 1
            16    8  17 1
            17    8  18 1 #Up
            18   10  19 1
            19   11  20 2
            20   14  21 2
            21   15  22 1
            22   17  23 1
            23   17  24 2
            24   19  25 2
            25   23  26 1
            26   25  27 1
            27   27  28 1
            28    7  12 1
            29    8  13 1
            30    9  10 1
            31   16  21 1
            32   20  25 1

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