KEGG   DRUG: NelarabineHelp
Entry
D05134                      Drug                                   

Name
Nelarabine (JAN/USAN/INN);
Nelzarabine (USAN);
Arranon (TN)
Product
Formula
C11H15N5O5
Exact mass
297.1073
Mol weight
297.2673
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antineoplastic
 DG01958  Nucleic acid derivative, antineoplastic
  DG01439  Arabinofuranosyl type antineoplastic
 DG01439  Arabinofuranosyl type antineoplastic
 DG02018  Antimetabolite
  DG01958  Nucleic acid derivative, antineoplastic
   DG01439  Arabinofuranosyl type antineoplastic
Remark
Therapeutic category: 4229
ATC code: L01BB07
Product: D05134<JP/US>
Efficacy
Antineoplastic, Antimetabolite
  Disease
T-cell malignancies [DS:H00002]
Target
DNA polymerase
Metabolism
Enzyme: ADA [HSA:100]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01B ANTIMETABOLITES
    L01BB Purine analogues
     L01BB07 Nelarabine
      D05134  Nelarabine (JAN/USAN/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   422  Antimetabolites
    4229  Others
     D05134  Nelarabine (JAN/USAN/INN); Nelzarabine (USAN)
Antineoplastics [br08340.html]
 D05134
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D05134
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D05134
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D05134
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D05134
BRITE hierarchy
Other DBs
CAS: 121032-29-9
PubChem: 47206859
ChEBI: 63612
ChEMBL: CHEMBL1201112
DrugBank: DB01280
LigandBox: D05134
LinkDB All DBs
KCF data Show

ATOM        21
            1   N4y N    32.0322  -15.7888
            2   C8y C    33.0170  -16.6193
            3   C1y C    30.7477  -16.2037
            4   C8x C    32.6448  -14.4430
            5   C8y C    34.3294  -15.8362
            6   N5x N    33.0211  -18.0454
            7   O2x O    29.6092  -15.3511
            8   C1y C    30.3156  -17.4530
            9   N5x N    34.0857  -14.4471
            10  C8y C    35.5269  -16.5024
            11  C8y C    34.2787  -18.7580
            12  C1y C    28.4999  -16.1452
            13  C1y C    28.9320  -17.4530
            14  N5x N    35.5482  -17.9940
            15  O2a O    36.7096  -15.7885
            16  C1b C    27.1805  -15.7190
            17  O1a O    28.4882  -18.7723
            18  O1a O    26.1470  -16.6532
            19  N1a N    34.2969  -20.1733
            20  O1a O    31.1199  -18.5820
            21  C1a C    37.9346  -16.4642
BOND        23
            1     2   6 1
            2     3   7 1
            3     3   8 1
            4     4   9 2
            5     5  10 1
            6     6  11 2
            7     7  12 1
            8     8  13 1
            9    10  14 2
            10   10  15 1
            11   12  16 1 #Up
            12   13  17 1 #Down
            13   16  18 1
            14    5   9 1
            15   11  14 1
            16   12  13 1
            17    1   2 1
            18    3   1 1 #Up
            19    1   4 1
            20    2   5 2
            21   11  19 1
            22    8  20 1 #Up
            23   15  21 1

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