KEGG   DRUG: OseltamivirHelp
Entry
D08306                      Drug                                   

Name
Oseltamivir (INN);
Agucort (TN)
Formula
C16H28N2O4
Exact mass
312.2049
Mol weight
312.4045
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antiviral
 DG02842  Neuraminidase inhibitor
Transporter substrate
 DG02859  SLC22A6 (OAT1) substrate
Remark
Same as: C08092
ATC code: J05AH02
Chemical structure group: DG00665
Product (DG00665): D00900<JP/US>
Efficacy
Antiviral, Neuraminidase inhibitor
Target
Influenza A/B virus neuraminidase [KO:K19392]
  Pathway
ko05164  Influenza A
Structure map
map07044  Antiviral agents
Other map
map04976  Bile secretion
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J05 ANTIVIRALS FOR SYSTEMIC USE
   J05A DIRECT ACTING ANTIVIRALS
    J05AH Neuraminidase inhibitors
     J05AH02 Oseltamivir
      D08306  Oseltamivir (INN)
USP drug classification [BR:br08302]
 Antivirals
  Anti-influenza Agents
   Oseltamivir
    D08306  Oseltamivir (INN)
BRITE hierarchy
Other DBs
CAS: 196618-13-0
PubChem: 96024993
ChEBI: 7798
ChEMBL: CHEMBL1229
DrugBank: DB00198
LigandBox: D08306
NIKKAJI: J871.765F
LinkDB All DBs
KCF data Show

ATOM        22
            1   C1x C    20.8600  -15.5400
            2   C1y C    20.8600  -16.9400
            3   C1y C    22.0500  -17.6400
            4   C1y C    23.3100  -16.9400
            5   C2x C    23.3100  -15.5400
            6   C2y C    22.0500  -14.8400
            7   N1b N    22.0500  -19.0400
            8   C5a C    20.8600  -19.7400
            9   O5a O    19.6700  -19.0400
            10  C1a C    20.8600  -21.1400
            11  N1a N    19.6700  -17.6400
            12  O2a O    24.5000  -17.6400
            13  C1c C    25.7600  -16.9400
            14  C1b C    26.9500  -17.6400
            15  C1a C    28.1400  -16.9400
            16  C1b C    25.7600  -15.5400
            17  C1a C    26.9500  -14.8400
            18  C7a C    22.0500  -13.4400
            19  O6a O    20.8600  -12.7400
            20  O7a O    23.2400  -12.7400
            21  C1b C    24.4300  -13.4400
            22  C1a C    25.6200  -12.7400
BOND        22
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     3   7 1 #Down
            8     7   8 1
            9     8   9 2
            10    8  10 1
            11    2  11 1 #Up
            12    4  12 1 #Up
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   13  16 1
            17   16  17 1
            18    6  18 1
            19   18  19 2
            20   18  20 1
            21   20  21 1
            22   21  22 1

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