KEGG   DRUG: NepinaloneHelp
Entry
D07396                      Drug                                   

Name
Nepinalone (INN)
Formula
C18H25NO
Exact mass
271.1936
Mol weight
271.3972
Structure
Mol fileKCF fileDB search
Remark
ATC code: R05DB26
Efficacy
Antitussive
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R05 COUGH AND COLD PREPARATIONS
   R05D COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
    R05DB Other cough suppressants
     R05DB26 Nepinalone
      D07396  Nepinalone (INN)
BRITE hierarchy
Other DBs
CAS: 22443-11-4
PubChem: 51091732
ChEMBL: CHEMBL2105148
LigandBox: D07396
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8x C    15.1900  -17.1500
            2   C8x C    15.1900  -18.5500
            3   C8x C    16.4024  -19.2500
            4   C8y C    17.6149  -18.5500
            5   C8y C    17.6149  -17.1500
            6   C8x C    16.4024  -16.4500
            7   C1x C    18.8273  -19.2500
            8   C1x C    20.0397  -18.5500
            9   C5x C    20.0397  -17.1500
            10  C1z C    18.8273  -16.4500
            11  C1b C    19.5273  -15.0976
            12  C1a C    17.8387  -15.4614
            13  C1b C    20.7198  -15.0975
            14  N1y N    21.4997  -13.7576
            15  C1x C    22.8507  -14.1196
            16  C1x C    23.8406  -13.1296
            17  C1x C    23.4783  -11.7773
            18  C1x C    22.1274  -11.4153
            19  C1x C    21.1374  -12.4052
            20  O5x O    21.2373  -16.4585
BOND        22
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12   10  11 1
            13   10  12 1
            14   11  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   14  19 1
            22    9  20 2

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