KEGG   COMPOUND: C11784
Entry
C11784                      Compound                               

Name
Echitovenine
Formula
C23H28N2O4
Exact mass
396.2049
Mol weight
396.4794
Structure
Reaction
Pathway
map00901  Indole alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C11784  Echitovenine
Other DBs
PubChem: 13948
ChEBI: 4752
3DMET: B05544
NIKKAJI: J143.635J
KCF data

ATOM        29
            1   C1z C    26.0680  -16.3719
            2   C1y C    27.2561  -15.6814
            3   C2y C    26.0738  -17.7367
            4   C8y C    23.7174  -16.3719
            5   C1x C    25.2007  -15.2494
            6   C1z C    28.4502  -16.3660
            7   N1y N    27.2444  -14.2987
            8   C2y C    27.2678  -18.4227
            9   N1x N    24.8927  -18.4227
            10  C8y C    23.7174  -17.7367
            11  C8x C    22.5364  -15.6988
            12  C1x C    25.8212  -14.0058
            13  C1x C    28.4619  -17.7427
            14  C1x C    29.6430  -15.6697
            15  C1c C    29.6078  -17.0345
            16  C1x C    28.4443  -13.6010
            17  C8x C    22.5364  -18.4287
            18  C8x C    21.3728  -16.3719
            19  C1x C    29.5787  -14.2870
            20  C1a C    30.7714  -16.3602
            21  C8x C    21.3728  -17.7367
            22  C7a C    27.3330  -19.8079
            23  O7a O    28.4719  -20.4937
            24  O6a O    26.0541  -20.4937
            25  C1a C    28.4648  -21.8863
            26  O7a O    29.6089  -18.4342
            27  C7a C    30.8217  -19.1331
            28  O6a O    30.8227  -20.5329
            29  C1a C    32.0333  -18.4324
BOND        33
            1     2   7 1
            2     3   8 2
            3     3   9 1
            4     4  10 2
            5     4  11 1
            6     5  12 1
            7     6  13 1
            8     6  14 1
            9     6  15 1 #Down
            10    7  16 1
            11   10  17 1
            12   11  18 2
            13   14  19 1
            14   15  20 1
            15   17  21 2
            16    7  12 1
            17    8  13 1
            18    9  10 1
            19   16  19 1
            20   18  21 1
            21    8  22 1
            22    1   2 1
            23   22  23 1
            24    1   3 1
            25   22  24 2
            26    1   4 1
            27   23  25 1
            28   15  26 1
            29   26  27 1
            30    1   5 1 #Up
            31   27  28 2
            32    2   6 1
            33   27  29 1

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