KEGG   DRUG: AcadesineHelp
Entry
D02742                      Drug                                   

Name
Acadesine (USAN/INN)
Formula
C9H14N4O5
Exact mass
258.0964
Mol weight
258.2313
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C04663
ATC code: C01EB13
Efficacy
Antineoplastic, Platelet aggregation inhibitor
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01E OTHER CARDIAC PREPARATIONS
    C01EB Other cardiac preparations
     C01EB13 Acadesine
      D02742  Acadesine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 2627-69-2
PubChem: 17396905
ChEBI: 28498
ChEMBL: CHEMBL1551724
LigandBox: D02742
NIKKAJI: J14.878D
LinkDB All DBs
KCF data Show

ATOM        18
            1   C1y C    26.5608  -19.4922
            2   C1y C    26.9833  -18.1544
            3   C1y C    25.1526  -19.4922
            4   O2x O    25.8567  -17.3095
            5   N4y N    28.1098  -17.4503
            6   C1y C    24.7301  -18.1544
            7   O1a O    27.2649  -20.6892
            8   O1a O    24.4485  -20.6892
            9   C1b C    23.4627  -17.4503
            10  O1a O    22.2658  -18.1544
            11  C8y C    29.4283  -17.8959
            12  C8y C    30.2715  -16.7783
            13  N5x N    29.4692  -15.6310
            14  C8x C    28.1301  -16.0396
            15  C5a C    31.6400  -16.8035
            16  N1a N    29.8456  -19.2472
            17  O5a O    32.3637  -15.6016
            18  N1a N    32.3161  -18.0259
BOND        19
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1 #Up
            5     3   6 1
            6     4   6 1
            7     1   7 1 #Down
            8     3   8 1 #Down
            9     9  10 1
            10    6   9 1 #Up
            11    5  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    5  14 1
            16   12  15 1
            17   11  16 1
            18   15  17 2
            19   15  18 1

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