Preferred Name

atorvastatin

Synonyms

(3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid

Atorvastatin

atorvastatinum

atorvastatin

atorvastatina

(R-(R*,R*))-2-(4-Fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-3-phenyl-4-((phenylamino)carbonyl)-1H-pyrrole-1-heptanoic acid

atorvastatine

7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL]-3,5-DIHYDROXY-HEPTANOIC ACID

Atorlip

Definitions

A dihydroxy monocarboxylic acid that is a member of the drug class known as statins, used primarily for lowering blood cholesterol and for preventing cardiovascular diseases.

ID

http://purl.obolibrary.org/obo/CHEBI_39548

charge

0

database_cross_reference

Reaxys:8373630

HMDB:HMDB0005006

Patent:US5273995

Beilstein:8373630

LINCS:LSM-5771

PDBeChem:117

PMID:15012735

PMID:18720283

Drug_Central:257

Wikipedia:Atorvastatin

KEGG:D07474

Patent:EP409281

KEGG:C06834

DrugBank:DB01076

CAS:134523-00-5

PMID:11693468

definition

A dihydroxy monocarboxylic acid that is a member of the drug class known as statins, used primarily for lowering blood cholesterol and for preventing cardiovascular diseases.

formula

C33H35FN2O5

has exact synonym

(3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid

Atorvastatin

has functional parent

http://purl.obolibrary.org/obo/CHEBI_45571

has role

http://purl.obolibrary.org/obo/CHEBI_35703

http://purl.obolibrary.org/obo/CHEBI_78298

has_alternative_id

CHEBI:39538

CHEBI:2910

has_obo_namespace

chebi_ontology

has_related_synonym

atorvastatinum

atorvastatin

atorvastatina

(R-(R*,R*))-2-(4-Fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-3-phenyl-4-((phenylamino)carbonyl)-1H-pyrrole-1-heptanoic acid

atorvastatine

7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL]-3,5-DIHYDROXY-HEPTANOIC ACID

Atorlip

id

CHEBI:39548

in_subset

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

inchi

InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1

inchikey

XUKUURHRXDUEBC-KAYWLYCHSA-N

is conjugate acid of

http://purl.obolibrary.org/obo/CHEBI_50690

label

atorvastatin

mass

558.63988

monoisotopicmass

558.25300

notation

CHEBI:39548

prefLabel

atorvastatin

smiles

CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(O)=O

subClassOf

http://purl.obolibrary.org/obo/CHEBI_26455

http://purl.obolibrary.org/obo/CHEBI_87635

http://purl.obolibrary.org/obo/CHEBI_62733

http://purl.obolibrary.org/obo/CHEBI_83575

http://purl.obolibrary.org/obo/CHEBI_35972

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Delete Mapping To Ontology Source
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