KEGG   COMPOUND: C09082Help
Entry
C09082                      Compound                               

Name
Borreverine
Formula
C32H40N4
Exact mass
480.3253
Mol weight
480.6868
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 51109-65-0
PubChem: 11274
ChEBI: 3156
KNApSAcK: C00001693
3DMET: B02669
NIKKAJI: J11.192I
KCF data Show

ATOM        36
            1   C8x C    25.4309  -14.4004
            2   C8x C    24.2354  -15.0964
            3   C8x C    24.2408  -16.4836
            4   C8x C    26.6387  -15.0918
            5   C8y C    26.6406  -16.4731
            6   C8y C    25.4382  -17.1707
            7   N4x N    25.7347  -18.5248
            8   C8y C    27.1133  -18.6585
            9   C8y C    27.6776  -17.3914
            10  C1y C    29.1419  -20.2975
            11  C1y C    29.1419  -21.6823
            12  C2x C    30.3490  -22.3747
            13  C2y C    31.5422  -21.6823
            14  C1x C    31.5422  -20.2975
            15  C1z C    30.3490  -19.5980
            16  C8x C    23.2911  -21.4280
            17  C8x C    23.2911  -22.8129
            18  C8x C    24.4843  -23.5050
            19  C8x C    24.4843  -20.7355
            20  C8y C    25.6845  -21.4280
            21  C8y C    25.6861  -22.8139
            22  N1x N    27.0038  -23.2449
            23  C1z C    27.0012  -20.9939
            24  C1z C    27.8247  -22.1217
            25  C1y C    27.8170  -19.8673
            26  C1b C    28.8656  -16.7013
            27  C1b C    30.0597  -17.3796
            28  N1b N    31.2536  -16.6942
            29  C1a C    32.4477  -17.3725
            30  C1x C    28.3851  -20.9898
            31  N1y N    28.5053  -23.3143
            32  C1x C    29.8406  -22.9470
            33  C1a C    28.4982  -24.7062
            34  C1a C    32.7302  -22.3747
            35  C1a C    29.7758  -17.9770
            36  C1a C    31.3172  -18.6161
BOND        42
            1    18  21 1
            2    20  19 1
            3    19  16 2
            4     9   5 1
            5     4   1 2
            6    20  21 2
            7    21  22 1
            8    22  24 1
            9    23  20 1
            10    1   2 1
            11    2   3 2
            12    3   6 1
            13   23  24 1
            14   24  11 1
            15   10  25 1
            16   25  23 1
            17   25   8 1
            18    5   4 1
            19    9  26 1
            20   10  11 1
            21   26  27 1
            22   11  12 1
            23   27  28 1
            24   12  13 2
            25   28  29 1
            26   13  14 1
            27   23  30 1 #Up
            28   14  15 1
            29   24  31 1 #Up
            30   15  10 1
            31   31  32 1
            32   30  32 1
            33    5   6 2
            34   31  33 1
            35    6   7 1
            36   13  34 1
            37    7   8 1
            38    8   9 2
            39   15  35 1
            40   16  17 1
            41   15  36 1
            42   17  18 2

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