KEGG   COMPOUND: C13252
Entry
C13252                      Compound                               
Name
Carmofur;
1-Hexylcarbamoyl-5-fluorouracil
Formula
C11H16FN3O3
Exact mass
257.1176
Mol weight
257.26
Structure
Remark
Same as: D01784
Reaction
Pathway
map00983  Drug metabolism - other enzymes
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01B ANTIMETABOLITES
    L01BC Pyrimidine analogues
     L01BC04 Carmofur
      D01784  Carmofur (JP18/INN)
Drug groups [BR:br08330]
 Antineoplastic
  DG02018  Antimetabolite
   DG01958  Nucleic acid derivative, antineoplastic
    DG01935  Fluoropyrimidine antineoplastic
     D01784  Carmofur
Target-based classification of drugs [BR:br08310]
 Enzymes
  Transferases (EC2)
   Methyltransferases
    TYMS
     D01784  Carmofur (JP18/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01784  Carmofur
Prodrugs [br08324.html]
 D01784
Other DBs
CAS: 61422-45-5
PubChem: 585996
LinkDB
KCF data

ATOM        18
            1   N4x N    24.1102  -16.8225
            2   C8y C    24.0859  -15.4359
            3   C8y C    22.8254  -14.7238
            4   C8x C    21.6261  -15.4580
            5   N4y N    21.6504  -16.8445
            6   C8y C    22.9110  -17.5568
            7   O5x O    22.8655  -18.9433
            8   X   F    22.8009  -13.3373
            9   O5x O    25.2852  -14.7017
            10  C5a C    20.5112  -17.5420
            11  N1b N    19.2875  -16.9277
            12  O5a O    20.5021  -18.9885
            13  C1b C    18.0656  -17.6356
            14  C1b C    16.8477  -16.9325
            15  C1b C    15.6300  -17.6356
            16  C1b C    14.4122  -16.9325
            17  C1b C    13.1943  -17.6356
            18  C1a C    11.9765  -16.9325
BOND        18
            1     2   9 2
            2     3   4 2
            3     5  10 1
            4     4   5 1
            5    10  11 1
            6     5   6 1
            7    10  12 2
            8     6   1 1
            9     6   7 2
            10    1   2 1
            11    3   8 1
            12    2   3 1
            13   11  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1

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