Chemical Entities of Biological Interest Ontology

Last uploaded: January 1, 2025
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Id http://purl.obolibrary.org/obo/CHEBI_134677
http://purl.obolibrary.org/obo/CHEBI_134677
Preferred Name

crisaborole
Definitions
A member of the class of benzoxaboroles that is 5-hydroxy-1,3-dihydro-2,1-benzoxaborole in which the phenolic hydrogen has been replaced by a 4-cyanophenyl group. A phosphodiesterase 4 inhibitor that is used for treatment of mild to moderate atopic dermatitis in children and adults.
Synonyms
AN 2728
AN2728
Crisaborole topical ointment 2%
crisaborole
AN-2728
Eucrisa
4-[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-5-yl)oxy]benzonitrile
Type http://www.w3.org/2002/07/owl#Class

All Properties

definition

A member of the class of benzoxaboroles that is 5-hydroxy-1,3-dihydro-2,1-benzoxaborole in which the phenolic hydrogen has been replaced by a 4-cyanophenyl group. A phosphodiesterase 4 inhibitor that is used for treatment of mild to moderate atopic dermatitis in children and adults.
label
crisaborole
prefLabel
crisaborole
database_cross_reference
PMID:27525671
PMID:24852768
PMID:20094643
PMID:23625818
PMID:27193740
PMID:27335049
PMID:26885784
PMID:27417017
PMID:26461821
PMID:28163553
PMID:27928191
KEGG:D10873
PMID:26659931
PMID:27353073
Reaxys:11622826
PMID:27283509
CAS:906673-24-3
PMID:19876791
PMID:26777394
PMID:27050693
PMID:19303290
PMID:20383346
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notation
CHEBI:134677
in_subset
inchi
InChI=1S/C14H10BNO3/c16-8-10-1-3-12(4-2-10)19-13-5-6-14-11(7-13)9-18-15(14)17/h1-7,17H,9H2
has_related_synonym
AN 2728
AN2728
Crisaborole topical ointment 2%
crisaborole
AN-2728
Eucrisa
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id
CHEBI:134677
charge
0
has_obo_namespace
chebi_ontology
formula
C14H10BNO3
subClassOf
inchikey
USZAGAREISWJDP-UHFFFAOYSA-N
mass
251.046
monoisotopicmass
251.07537
type
smiles
C1=C(C=C2C(=C1)B(OC2)O)OC3=CC=C(C=C3)C#N
has role
has_exact_synonym
4-[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-5-yl)oxy]benzonitrile
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