KEGG   DRUG: Torcitabine
Entry
D06196                      Drug                                   
Name
Torcitabine (USAN/INN)
Formula
C9H13N3O4
Exact mass
227.0906
Mol weight
227.2172
Structure
Simcomp
Class
Antiviral
 DG01440  Arabinofuranosyl type antiviral
Remark
Same as: C21554
Efficacy
Antiviral
Comment
Treatment of hepatitis B infection
Target
HBV reverse transcriptase [KO:K21037]
  Pathway
ko03230  Viral genome structure
ko03240  Viral replication
ko05161  Hepatitis B
Brite
Drug groups [BR:br08330]
 Antiviral
  DG01440  Arabinofuranosyl type antiviral
   D06196  Torcitabine
Antimicrobials [BR:br08307]
 Antivirals
  Genome replication inhibitor
   HBV reverse transcriptase inhibitor
    D06196  Torcitabine (USAN/INN)
Prodrugs [br08324.html]
 D06196
Other DBs
CAS: 40093-94-5
PubChem: 47207854
PDB-CCD: LDC[PDBj]
LigandBox: D06196
LinkDB
KCF data

ATOM        16
            1   C1y C    18.3106  -15.9773
            2   N4y N    19.6440  -15.5577
            3   O2x O    17.1672  -15.1140
            4   C1x C    17.8965  -17.2725
            5   C8y C    20.8438  -16.2612
            6   C8x C    19.6538  -14.1739
            7   C1y C    16.0413  -15.9541
            8   C1y C    16.4788  -17.2725
            9   N5x N    22.0649  -15.5782
            10  O5x O    20.8447  -17.6665
            11  C8x C    20.8655  -13.4750
            12  C1b C    14.7054  -15.5282
            13  O1a O    16.0471  -18.6376
            14  C8y C    22.0621  -14.1912
            15  O1a O    13.6729  -16.4674
            16  N1a N    23.2946  -13.5056
BOND        17
            1     1   2 1 #Down
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    7  12 1 #Down
            12    8  13 1 #Up
            13    9  14 2
            14   12  15 1
            15   14  16 1
            16    7   8 1
            17   11  14 1

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