KEGG   COMPOUND: C02961Help
Entry
C02961                      Compound                               

Name
Cytarabine;
Cytosine arabinoside;
Cytosine-1-beta-D-arabinofuranoside;
Ara-C
Formula
C9H13N3O5
Exact mass
243.0855
Mol weight
243.2166
Structure
Mol fileKCF fileDB search
Remark
Same as: D00168
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01B ANTIMETABOLITES
    L01BC Pyrimidine analogues
     L01BC01 Cytarabine
      D00168  Cytarabine (JP17/USP/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   422  Antimetabolites
    4224  Cytosines
     D00168  Cytarabine (JP17/USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00168  Cytarabine
Antineoplastics [br08340.html]
 D00168
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D00168
Prodrugs [br08324.html]
 D00168
BRITE hierarchy
Other DBs
CAS: 147-94-4
PubChem: 5877
ChEBI: 28680
ChEMBL: CHEMBL803
PDB-CCD: AR3[PDBj]
NIKKAJI: J2.958K
LinkDB All DBs
KCF data Show

ATOM        17
            1   C1y C    23.7300  -16.9400
            2   N4y N    25.0600  -16.5200
            3   O2x O    22.6100  -16.1700
            4   C1y C    23.3100  -18.2700
            5   C8y C    26.2500  -17.2200
            6   C8x C    25.0600  -15.1200
            7   C1y C    21.4900  -16.9400
            8   C1y C    21.9100  -18.2700
            9   O1a O    24.0800  -19.4600
            10  N5x N    27.5100  -16.5200
            11  O5x O    26.2500  -18.6200
            12  C8x C    26.2500  -14.4200
            13  C1b C    20.0900  -16.5200
            14  O1a O    21.0700  -19.4600
            15  C8y C    27.5100  -15.1200
            16  O1a O    19.1100  -17.5000
            17  N1a N    28.7000  -14.4200
BOND        18
            1     1   2 1 #Up
            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     4   9 1 #Up
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    7  13 1 #Up
            13    8  14 1 #Down
            14   10  15 2
            15   13  16 1
            16   15  17 1
            17    7   8 1
            18   12  15 1

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