KEGG   COMPOUND: C22951
Entry
C22951                      Compound                               
Name
Akuammiline
Formula
C23H26N2O4
Exact mass
394.1893
Mol weight
394.46
Structure
Reaction
R13362
Pathway
map00901  Indole alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
2.3.1.322
Other DBs
CAS: 1897-26-3
PubChem: 500141082
LinkDB
KCF data

ATOM        29
            1   C8x C    19.0400  -19.1100
            2   C8x C    19.0400  -20.5100
            3   C8x C    20.2300  -21.2100
            4   C8y C    21.4900  -20.5100
            5   C8y C    21.4900  -19.1100
            6   C8x C    20.2300  -18.4100
            7   N2x N    22.6800  -21.2100
            8   C2y C    23.8700  -20.5100
            9   C1z C    23.8700  -19.1100
            10  C1y C    25.1300  -21.2100
            11  N1y N    26.3200  -20.5100
            12  C1x C    26.3200  -19.1100
            13  C1x C    25.1300  -18.4100
            14  C1x C    25.1300  -22.6100
            15  C1y C    26.3200  -23.3100
            16  C2y C    27.5100  -22.6100
            17  C1x C    27.5100  -21.2100
            18  C2b C    28.7700  -23.3100
            19  C1a C    28.7700  -24.7100
            20  C1z C    24.9900  -17.4300
            21  C7a C    25.9700  -16.4500
            22  O6a O    27.3000  -16.8000
            23  O7a O    25.6200  -15.1200
            24  C1a C    26.8100  -13.8600
            25  C1b C    24.0100  -16.4500
            26  O7a O    22.6800  -16.8000
            27  C7a C    21.7000  -15.8200
            28  C1a C    20.3700  -16.1700
            29  O6a O    22.0500  -14.4900
BOND        33
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9   5 1 #Down
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16   10  14 1
            17   14  15 1
            18   15  16 1
            19   16  17 1
            20   11  17 1
            21   16  18 2
            22   18  19 1
            23    9  20 1
            24   15  20 1
            25   20  21 1
            26   21  22 2
            27   21  23 1
            28   23  24 1
            29   20  25 1 #Up
            30   25  26 1
            31   26  27 1
            32   27  28 1
            33   27  29 2

» Japanese version

DBGET integrated database retrieval system