KEGG   COMPOUND: C19897
Entry
C19897                      Compound                               
Name
Debromohymenialdisine;
(Z)-Debromohymenialdisine;
DBH
Formula
C11H11N5O2
Exact mass
245.0913
Mol weight
245.24
Structure
Other DBs
PubChem: 135626363
KNApSAcK: C00049341
PDB-CCD: DBQ[PDBj]
LinkDB
KCF data

ATOM        18
            1   N1x N    26.5544  -18.5085
            2   C5x C    27.7693  -17.8210
            3   C8y C    29.0717  -18.3357
            4   C8y C    29.4767  -19.6657
            5   C1x C    26.3408  -19.9013
            6   C2y C    28.6906  -20.8973
            7   C1x C    27.2929  -20.9282
            8   C8x C    30.8667  -19.6914
            9   C8x C    31.3208  -18.3776
            10  N4x N    30.2114  -17.5397
            11  O5x O    27.8148  -16.4547
            12  C2y C    29.9447  -22.0666
            13  C5x C    30.3937  -23.3926
            14  N2x N    31.7936  -23.3753
            15  C2y C    32.2098  -22.0386
            16  N1x N    31.0670  -21.2298
            17  O5x O    29.5863  -24.5333
            18  N1a N    33.5236  -21.5938
BOND        20
            1     3   4 2
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     4   8 1
            9     8   9 2
            10    9  10 1
            11    3  10 1
            12    2  11 2
            13   12  13 1
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   12  16 1
            18    6  12 2
            19   13  17 2
            20   15  18 1

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