KEGG   DRUG: ButambenHelp
Entry
D00730                      Drug                                   

Name
Butamben (USP);
4-Aminobenzoic acid butyl;
Butesin (TN)
Formula
C11H15NO2
Exact mass
193.1103
Mol weight
193.2423
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C07875
Chemical structure group: DG02875
Efficacy
Anesthetic (topical), Potassium channel blocker
Target
KCND [HSA:3750 3751 3752] [KO:K04891 K04892 K04893]
  Pathway
hsa04726  Serotonergic synapse
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Potassium channels
    KCND
     D00730  Butamben (USP)
BRITE hierarchy
Other DBs
CAS: 94-25-7
PubChem: 7847795
ChEBI: 3231
ChEMBL: CHEMBL127516
LigandBox: D00730
NIKKAJI: J4.698A
LinkDB All DBs
KCF data Show

ATOM        14
            1   C8y C    16.7590  -11.5874
            2   C7a C    17.9472  -12.2863
            3   C8x C    16.7590  -10.1895
            4   C8x C    15.5708  -12.2863
            5   O7a O    19.2053  -11.5874
            6   O6a O    17.9472  -13.6842
            7   C8x C    15.5708   -9.4906
            8   C8x C    14.3127  -11.5874
            9   C1b C    20.3935  -12.2863
            10  C8y C    14.3127  -10.1895
            11  C1b C    21.5817  -11.5874
            12  N1a N    13.1245   -9.4906
            13  C1b C    22.8397  -12.2863
            14  C1a C    24.0279  -11.5874
BOND        14
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     7  10 2
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   13  14 1
            14    8  10 1

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