KEGG   DRUG: PhenacetinHelp
Entry
D00569                      Drug                                   

Name
Phenacetin (JAN/INN)
Formula
C10H13NO2
Exact mass
179.0946
Mol weight
179.2157
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-inflammatory
 DG01981  Antiinflammatory drug, anilide derivatives
Remark
Same as: C07591
ATC code: N02BE03
Efficacy
Antipyretic
Comment
Acetanilide derivative
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02B OTHER ANALGESICS AND ANTIPYRETICS
    N02BE Anilides
     N02BE03 Phenacetin
      D00569  Phenacetin (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 62-44-2
PubChem: 7847635
ChEBI: 8050
ChEMBL: CHEMBL16073
DrugBank: DB03783
PDB-CCD: N4E[PDBj]
LigandBox: D00569
NIKKAJI: J2.348E
LinkDB All DBs
KCF data Show

ATOM        13
            1   C8y C    25.7820  -18.4927
            2   C8x C    25.7820  -19.8967
            3   C8x C    24.5704  -17.7937
            4   N1b N    26.9995  -17.7996
            5   C8x C    24.5704  -20.5957
            6   C8x C    23.3587  -18.4927
            7   C5a C    28.2112  -18.4927
            8   C8y C    23.3587  -19.8967
            9   C1a C    29.4169  -17.7996
            10  O5a O    28.2112  -19.8967
            11  O2a O    22.1412  -20.6014
            12  C1b C    20.9296  -19.8967
            13  C1a C    19.7238  -20.6014
BOND        13
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     7   9 1
            9     7  10 2
            10    8  11 1
            11   11  12 1
            12   12  13 1
            13    6   8 2

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