KEGG   COMPOUND: C20528Help
Entry
C20528                      Compound                               

Name
Terpendole B
Formula
C27H35NO3
Exact mass
421.2617
Mol weight
421.5717
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00403  Indole diterpene alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Other DBs
PubChem: 254741161
KCF data Show

ATOM        31
            1   C8x C    11.5440  -15.0433
            2   C8x C    11.5440  -16.4427
            3   C8x C    12.7335  -17.1424
            4   C8y C    13.9230  -16.4427
            5   C8y C    13.9230  -15.0433
            6   C8x C    12.7335  -14.3436
            7   N4x N    15.3224  -16.9325
            8   C8y C    16.0921  -15.7430
            9   C8y C    15.3224  -14.6235
            10  C1z C    17.3515  -15.3232
            11  C1y C    17.3515  -13.9238
            12  C1x C    16.0921  -13.5040
            13  C1z C    18.6110  -15.9529
            14  C1y C    19.8005  -15.3232
            15  C1x C    19.8005  -13.9238
            16  C1x C    18.6110  -13.2941
            17  C1x C    18.6110  -17.4223
            18  C1x C    19.8005  -18.1220
            19  C1y C    20.9200  -17.4223
            20  C1z C    20.9200  -15.9529
            21  O2x O    22.1095  -18.1220
            22  C1y C    23.2990  -17.4223
            23  C1x C    23.2990  -15.9529
            24  C1y C    22.1095  -15.3232
            25  C1a C    17.3515  -16.7925
            26  C1d C    24.5584  -18.1220
            27  C1a C    18.0512  -14.4835
            28  O1a O    25.7479  -17.4223
            29  C1a C    24.5584  -19.7313
            30  C1a C    25.7479  -18.8217
            31  O2x O    22.1095  -16.7226
BOND        37
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14    9  12 1
            15   10  13 1
            16   13  14 1
            17   14  15 1
            18   15  16 1
            19   11  16 1
            20   13  17 1
            21   17  18 1
            22   18  19 1
            23   19  20 1
            24   14  20 1
            25   19  21 1
            26   21  22 1
            27   22  23 1
            28   23  24 1
            29   20  24 1
            30   10  25 1 #Down
            31   22  26 1 #Up
            32   13  27 1 #Up
            33   26  28 1
            34   26  29 1
            35   26  30 1
            36   24  31 1 #Down
            37   20  31 1 #Down

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