KEGG   COMPOUND: C20543
Entry
C20543                      Compound                               
Name
Terpendole I
Formula
C27H35NO5
Exact mass
453.2515
Mol weight
453.57
Structure
Reaction
Pathway
map00403  Indole diterpene alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.13.-       2.5.1.-
Other DBs
PubChem: 172232284
ChEBI: 144412
LinkDB
KCF data

ATOM        33
            1   C8x C    11.4975  -15.1479
            2   C8x C    11.4975  -16.5547
            3   C8x C    12.6934  -17.1878
            4   C8y C    13.8892  -16.5547
            5   C8y C    13.8892  -15.1479
            6   C8x C    12.6934  -14.4444
            7   N4x N    15.2258  -16.9768
            8   C8y C    16.0699  -15.8513
            9   C8y C    15.2258  -14.7258
            10  C1z C    17.3361  -15.4292
            11  C1y C    17.3361  -14.0224
            12  C1x C    16.0699  -13.6003
            13  C1z C    18.6023  -16.0623
            14  C1z C    19.7981  -15.4292
            15  C1x C    19.7981  -14.0224
            16  C1x C    18.6023  -13.3189
            17  C1x C    18.6023  -17.4692
            18  C1x C    19.7981  -18.1726
            19  C1y C    20.9940  -17.4692
            20  C1z C    20.9940  -16.0623
            21  O2x O    22.1898  -18.1726
            22  C1y C    23.3857  -17.4692
            23  C1y C    23.3857  -16.0623
            24  C1y C    22.1898  -15.4292
            25  C1a C    17.4064  -16.8361
            26  C1d C    24.6518  -18.1726
            27  C1a C    18.0395  -14.5851
            28  O1a O    25.8477  -17.4692
            29  C1a C    24.6518  -19.7905
            30  C1a C    25.8477  -18.8761
            31  O2x O    22.1898  -16.7658
            32  O1a O    24.5815  -15.3589
            33  O1a O    20.7929  -14.4345
BOND        39
            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   20  31 1 #Down
            37   24  31 1 #Down
            38   23  32 1 #Down
            39   14  33 1 #Down

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