KEGG   COMPOUND: C19441
Entry
C19441                      Compound                               
Name
Mannomustine dihydrochloride;
Degranol
Formula
C10H22Cl2N2O4. 2HCl
Exact mass
376.049
Mol weight
378.1206
Structure
Other DBs
CAS: 551-74-6
PubChem: 124490113
ChEBI: 82481
KCF data

ATOM        20
            1   X   Cl   20.4404  -16.3105
            2   C1b C    21.6529  -17.0105
            3   C1b C    22.8654  -16.3105
            4   N1b N    24.0778  -17.0105
            5   C1b C    25.2903  -16.3105
            6   C1c C    26.5028  -17.0105
            7   C1c C    27.7152  -16.3105
            8   C1c C    28.9277  -17.0105
            9   C1c C    30.1402  -16.3105
            10  C1b C    31.3527  -17.0105
            11  N1b N    32.5652  -16.3105
            12  C1b C    33.7776  -17.0105
            13  C1b C    34.9901  -16.3105
            14  X   Cl   36.2026  -17.0105
            15  O1a O    27.7152  -14.9105
            16  O1a O    28.9277  -18.4105
            17  O1a O    26.5028  -18.4103
            18  O1a O    30.1402  -14.9108
            19  X   Cl   33.4600  -18.9700
            20  X   Cl   24.0100  -20.0200
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14    7  15 1 #Up
            15    8  16 1 #Up
            16    6  17 1 #Down
            17    9  18 1 #Down

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