KEGG   DRUG: Butyl parahydroxybenzoateHelp
Entry
D01420                      Drug                                   

Name
Butyl parahydroxybenzoate (JP17);
Butylparaben (NF);
Butyl parahydroxybenzoate (TN);
Butylparaben (TN)
Formula
C11H14O3
Exact mass
194.0943
Mol weight
194.2271
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Activity
Pharmaceutic aid (antifungal)
Structure map
Benzoic acid family
Brite
Pharmaceutical additives in Japan [BR:br08316]
 Stabilizing agent
  D01420  [002293] Butyl parahydroxybenzoate
 Antiseptic agent
  D01420  [002293] Butyl parahydroxybenzoate
 Preserving agent
  D01420  [002293] Butyl parahydroxybenzoate
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01420  Butyl parahydroxybenzoate
BRITE hierarchy
Other DBs
CAS: 
94-26-8
PubChem: 
ChEMBL: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        14
            1   C8x C    19.8100  -15.8200
            2   C8x C    19.8100  -17.2200
            3   C8y C    21.0000  -17.9200
            4   C8x C    22.2600  -17.2200
            5   C8x C    22.2600  -15.8200
            6   C8y C    21.0000  -15.1200
            7   C7a C    21.0000  -13.7200
            8   O1a O    21.0000  -19.3200
            9   O7a O    19.8100  -13.0200
            10  O6a O    22.1900  -13.0200
            11  C1b C    18.5500  -13.7200
            12  C1b C    17.3600  -13.0200
            13  C1b C    16.1700  -13.7200
            14  C1a C    14.9800  -13.0200
BOND        14
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     6   7 1
            8     3   8 1
            9     7   9 1
            10    7  10 2
            11    9  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1

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