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Name:KETOCONAZOLE
PubChem ID:47576
Pathway:Show KEGG pathways
InChI:InChI=1/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m1/s1
SMILES:CC(N1CCN(CC1)c1ccc(cc1)OC[C@@H]1(CO[C@](Cn2ccnc2)(c2ccc(cc2Cl)Cl)O1))=O

Properties:
Formula:C26H28Cl2N4O4Atoms:37
Molecular Weight:531.431Rotatable Bonds:8
H-bond Acceptors:5H-bond Donors:0
logP:4.2087
Targets:
NameUniprot IDSourceReferencesInteraction
Cytochrome P450 11B1, mitochondrialC11B1_HUMANSuperCypPMID 7663533shows
Cytochrome P450 19A1CP19A_HUMANBindingDB-shows
Cytochrome P450 1A1CP1A1_HUMANSuperCypPMID 17283379shows
Cytochrome P450 1A2CP1A2_HUMANSuperCypPMID 9351907shows
Cytochrome P450 1B1CP1B1_HUMANSuperCypPMID 14709627shows
Cytochrome P450 26A1CP26A_HUMANSuperCypPMID 14532297shows
Cytochrome P450 2A6CP2A6_HUMANSuperCypPMID 9143352shows
Cytochrome P450 2B1CP2B1_RATBindingDB-shows
Cytochrome P450 2B6CP2B6_HUMANSuperCypPMID 14709627shows
Cytochrome P450 2C11CP2CB_RATBindingDB-shows
Cytochrome P450 2C19CP2CJ_HUMANSuperCypPMID 14709627shows
Cytochrome P450 2C8CP2C8_HUMANSuperCypPMID 14709627shows
Cytochrome P450 2C9CP2C9_HUMANSuperCypPMID 14709627shows
Cytochrome P450 2D6CP2D6_HUMANSuperCypPMID 15618748shows
Cytochrome P450 2F1CP2F1_HUMANSuperCypPMID 14709627shows
Cytochrome P450 3A4CP3A4_HUMANSuperCypPMID 8690825shows
Cytochrome P450 3A5CP3A5_HUMANSuperCypPMID 8690825shows
Cytochrome P450 3A7CP3A7_HUMANSuperCypPMID 8690825shows
Cytochrome P450 4A10CP4AA_RATBindingDB-shows
Heme oxygenase 1HMOX1_RATBindingDB-shows
Heme oxygenase 2HMOX2_RATBindingDB-shows
Lanosterol 14-alpha demethylaseCP51A_HUMANDrugBank-shows
Lanosterol 14-alpha demethylaseCP51_YEASTSuperTargetPMID 16941956shows
Leukotriene-B(4) omega-hydroxylase 1CP4F2_HUMANSuperCypPMID 16997912shows
Multidrug resistance protein 1MDR1_HUMANBindingDB-shows
Steroid 17-alpha-hydroxylase/17,20 lyaseCP17A_RATBindingDB-shows
Steroid 17-alpha-hydroxylase/17,20 lyaseCP17A_HUMANBindingDB-shows
Steroid 21-hydroxylaseCP21A_HUMANBindingDB-shows
Synonyms:
(+-)-cis-1-acetyl-4-(p-((2-(2,4-dichlorophenyl)-2-(imidazol-1- ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazine
(+-)-cis-1-Acetyl-4-(p-((2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazine
(-)-Ketoconazole
(2S,4R)-ketoconazole
1-acetyl-4-(4-{[(2S,4R)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-
1-ACETYL-4-(4-{[(2S,4R)-2-(2,4-DICHLOROPHENYL)-2-(1H-IMIDAZOL-1-YLMETHYL)-1,3-DIOXOLAN-4-YL]METHOXY}PHENYL)PIPERAZINE
1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
65277-42-1
AIDS-112209
AIDS112209
BRN 4303081
CAS-65277-42-1
CHEBI:47518
CORT-001
CPD-4503
D00351
DB01026
DRG-0073
EINECS 265-667-4
Extina
Fungarest
Fungoral
Ketocanazole
Ketoconazol
Ketoconazol [INN-Spanish]
KETOCONAZOLE
Ketoconazole (JAN/USP)
Ketoconazole [USAN:BAN:INN:JAN]
Ketoconazolum
Ketoconazolum [INN-Latin]
Ketoderm
Ketoisdin
Ketozole
KW-1414
Lopac-K-1003
NCGC00015577-01
NCGC00016907-01
NCGC00161836-01
NCGC00161836-02
Nizoral
Nizoral (TN)
Nizoral a-D
NSC 317629
Orifungal M
Panfungol
Piperazine, (-)-1-acetyl-4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-
piperazine, 1-acetyl-4-(4-((2-(2,4-dichlorophenyl)-2-(1H- imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-, cis-
Piperazine, 1-acetyl-4-(4-((2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-, cis-
R 41400
R-41400
Sebazole
Xolegel
Xolegel (TN)
ATC-Codes:
Side-Effects:
Side-EffectFrequency
abdominal pain0
nausea0
pain0
papilledema0
paresthesia0
pruritus0
swelling0
thrombocytopenia0
erythema0
urticaria0
vomiting0
chills0
photophobia0
pyogenic granuloma0
dry skin0
scalp seborrhea0
eye swelling0
acne0
leukopenia0
keratoconjunctivitis sicca0
alopecia0
anaphylaxis0
hemolytic anemia0
arrhythmia0
dermatitis0
contact dermatitis0
diarrhea0
dizziness0
somnolence0
rash0
fever0
gynecomastia0
headache0
hypersensitivity0
hypertriglyceridemia0
impetigo0
impotence0
allergic reaction0