KEGG   DRUG: Dimepranol acedoben
Entry
D03836                      Drug                                   
Name
Dimepranol acedoben (USAN)
Formula
C9H9NO3. C5H13NO
Exact mass
282.158
Mol weight
282.3355
Structure
Simcomp
Remark
Product (mixture): D01995<JP>
Efficacy
Immunomodulator
Other DBs
CAS: 61990-51-0
PubChem: 17397922
LigandBox: D03836
NIKKAJI: J310.998D
LinkDB
KCF data

ATOM        20
            1   C1b C    21.5023  -13.8017
            2   N1c N    22.6533  -14.5709
            3   C1c C    20.2702  -14.4205
            4   C1a C    22.7055  -15.9533
            5   C1a C    19.0499  -13.7958
            6   C1a C    23.9942  -13.8768
            7   O1a O    20.3348  -15.8196
            8   C8y C    13.4112  -14.9570
            9   C6a C    14.6255  -15.6518
            10  C8x C    13.4112  -13.5500
            11  C8x C    12.1967  -15.6577
            12  O6a O    15.8399  -14.9570
            13  O6a O    14.6255  -17.0589
            14  C8x C    12.1967  -12.8435
            15  C8x C    10.9881  -14.9628
            16  C8y C    10.9823  -13.5500
            17  N1b N     9.7621  -12.8494
            18  C5a C     8.5595  -13.5500
            19  C1a C     7.3510  -12.8494
            20  O5a O     8.5615  -14.9798
BOND        19
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     2   6 1
            6     3   7 1
            7     8   9 1
            8     8  10 1
            9     8  11 2
            10    9  12 1
            11    9  13 2
            12   10  14 2
            13   11  15 1
            14   14  16 1
            15   16  17 1
            16   17  18 1
            17   18  19 1
            18   15  16 2
            19   18  20 2

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