Preferred Name

ezetimibe

Synonyms

(3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one

Zetia

Ezedoc

ezetimiba

ezetimibum

ezetimibe

Ezetrol

Definitions

A beta-lactam that is azetidin-2-one which is substituted at 1, 3, and 4 by p-fluorophenyl, 3-(p-fluorophenyl)-3-hydroxypropyl, and 4-hydroxyphenyl groups, respectively (the 3R,3'S,4S enantiomer).

ID

http://purl.obolibrary.org/obo/CHEBI_49040

charge

0

database_cross_reference

CAS:163222-33-1

DrugBank:DB00973

PMID:17587760

Reaxys:7981967

Drug_Central:1125

Beilstein:7981967

PMID:23266293

LINCS:LSM-5536

PMID:23510093

PMID:18585981

PMID:23471229

PMID:23538020

HMDB:HMDB0015108

Wikipedia:Ezetimibe

PMID:23219178

KEGG:D01966

PMID:23317398

definition

A beta-lactam that is azetidin-2-one which is substituted at 1, 3, and 4 by p-fluorophenyl, 3-(p-fluorophenyl)-3-hydroxypropyl, and 4-hydroxyphenyl groups, respectively (the 3R,3'S,4S enantiomer).

formula

C24H21F2NO3

has exact synonym

(3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one

has role

http://purl.obolibrary.org/obo/CHEBI_35821

http://purl.obolibrary.org/obo/CHEBI_35221

has_obo_namespace

chebi_ontology

has_related_synonym

Zetia

Ezedoc

ezetimiba

ezetimibum

ezetimibe

Ezetrol

id

CHEBI:49040

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1

inchikey

OLNTVTPDXPETLC-XPWALMASSA-N

label

ezetimibe

mass

409.42520

monoisotopicmass

409.14895

notation

CHEBI:49040

prefLabel

ezetimibe

smiles

[H][C@]1(CC[C@H](O)c2ccc(F)cc2)C(=O)N(c2ccc(F)cc2)[C@]1([H])c1ccc(O)cc1

subClassOf

http://purl.obolibrary.org/obo/CHEBI_37143

http://purl.obolibrary.org/obo/CHEBI_35627

http://purl.obolibrary.org/obo/CHEBI_38777

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