KEGG   DRUG: CarboquoneHelp
Entry
D01270                      Drug                                   

Name
Carboquone (JAN/INN);
Esquinon (TN)
Formula
C15H19N3O5
Exact mass
321.1325
Mol weight
321.3285
Structure
Mol fileKCF fileDB search
Class
Antineoplastic
 DG01677  Alkylating agent
  DG01723  Ethylene imine
Remark
ATC code: L01AC03
Efficacy
Antineoplastic, Alkylating agent
Target
DNA
Interaction
Drug interaction
Structure map
map07040  Antineoplastics - alkylating agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01A ALKYLATING AGENTS
    L01AC Ethylene imines
     L01AC03 Carboquone
      D01270  Carboquone (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 24279-91-2
PubChem: 7848333
ChEBI: 31356
ChEMBL: CHEMBL443014
LigandBox: D01270
NIKKAJI: J16.850E
LinkDB All DBs
KCF data Show

ATOM        23
            1   C2y C    18.9282  -13.3571
            2   C2y C    18.9282  -11.9571
            3   C5x C    20.1436  -11.2571
            4   C2y C    21.3518  -11.9571
            5   C2y C    21.3518  -13.3571
            6   C5x C    20.1436  -14.0570
            7   O5x O    20.1454  -15.4570
            8   O5x O    20.1454   -9.8571
            9   N1y N    17.7163  -11.2566
            10  N1y N    22.5648  -14.0562
            11  C1a C    17.7163  -14.0577
            12  C1c C    22.5648  -11.2581
            13  C1b C    23.7767  -11.9590
            14  O7a O    24.9897  -11.2598
            15  C7a C    26.2015  -11.9608
            16  N1a N    27.4144  -11.2617
            17  O2a O    22.5658   -9.8581
            18  C1a C    23.7787   -9.1590
            19  O6a O    26.2004  -13.3608
            20  C1x C    23.9618  -14.0526
            21  C1x C    23.2583  -15.2678
            22  C1x C    16.3136  -11.2588
            23  C1x C    17.0185  -10.0445
BOND        25
            1     5   6 1
            2     4  12 1
            3     6   1 1
            4    12  13 1
            5    13  14 1
            6     6   7 2
            7    14  15 1
            8     1   2 2
            9    15  16 1
            10    3   8 2
            11   12  17 1
            12    2   3 1
            13   17  18 1
            14    2   9 1
            15   15  19 2
            16    3   4 1
            17    5  10 1
            18   10  20 1
            19   10  21 1
            20   21  20 1
            21    4   5 2
            22    1  11 1
            23    9  22 1
            24    9  23 1
            25   23  22 1

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