Experimental Factor Ontology

Last uploaded: November 18, 2024
Preferred Name

atorvastatin
Synonyms

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

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

atorvastatinum

atorvastatin

atorvastatine

atorvastatina

Atorlip

Atorvastatin

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

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

NCIt:C61527

MeSH:C065179

HMDB:HMDB0005006

Patent:US5273995

KEGG:D07474

KEGG:C06834

PMID:18720283

DrugBank:DB01076

Drug_Central:257

SNOMEDCT:373444002

PDBeChem:117

CAS:134523-00-5

Reaxys:8373630

Beilstein:8373630

Wikipedia:Atorvastatin

PMID:11693468

PMID:15012735

LINCS:LSM-5771

Patent:EP409281

SNOMEDCT:108600003

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 characteristic

http://www.ebi.ac.uk/efo/EFO_0001899

has_alternative_id

CHEBI:94450

CHEBI:39538

CHEBI:2910

has_exact_synonym

Atorvastatin

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

has_obo_namespace

chebi_ontology

has_related_synonym

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

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

atorvastatinum

atorvastatin

atorvastatine

atorvastatina

Atorlip

has_role

http://www.ebi.ac.uk/efo/EFO_0001899

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

label

atorvastatin

mass

558.650

monoisotopicmass

558.25300

notation

CHEBI:39548

preferred label

atorvastatin

prefLabel

atorvastatin

smiles

CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1

subClassOf

http://purl.obolibrary.org/obo/CHEBI_24532

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Delete Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_39548 OBA SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 CCONT SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 HOIP SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 COVID-19 SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 TXPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 DIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 ECTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 ODNAE SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 OBA SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548 OBA LOOM
http://purl.obolibrary.org/obo/XCO_0000628 XCO LOOM
http://purl.obolibrary.org/obo/XCO_0000628 XCO LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0286651 OCHV LOOM
http://bmi.utah.edu/ontologies/hfontology/C0286651 HFO LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000022046 NDFRT LOOM
http://www.ustb.edu.cn/thesauri/tocr/v1/data#C571353432175145004 ACVD_ONTOLOGY LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#27738 OCHV LOOM
http://stirdf.jst.go.jp/id/200907015692823190 IOBC LOOM
http://www.semanticweb.org/admin/ontologies/2022/7/MIO:02122 MIO LOOM
http://www.semanticweb.org/ontologies/STO.owl#OWLClass_d9c9be28_a87c_4598_bc8a_be2c03034e4f STO-DRAFT LOOM
http://www.semanticweb.org/ontologies/STO.owl#OWLClass_d9c9be28_a87c_4598_bc8a_be2c03034e4f CVAO LOOM
http://purl.obolibrary.org/obo/NCIT_C61527 BERO LOOM
http://purl.bioontology.org/ontology/ATC/C10AA05 ATC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C065179 RH-MESH LOOM
http://purl.bioontology.org/ontology/RCD/bxi.. RCD LOOM
http://purl.bioontology.org/ontology/LNC/LP171386-8 LOINC LOOM
http://purl.bioontology.org/ontology/RXNORM/83367 RXNORM LOOM
http://www.co-ode.org/ontologies/galen#Atorvastatin GALEN LOOM
http://www.drugbank.ca/drugs/DB01076 FTC LOOM
http://purl.bioontology.org/ontology/VANDF/4024041 VANDF LOOM
http://purl.bioontology.org/ontology/CSP/5002-0003 CRISP LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 CCONT LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 HOIP LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 COVID-19 LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 TXPO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 DIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 ECTO LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 ODNAE LOOM
http://purl.obolibrary.org/obo/CHEBI_39548 OBA LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000022046 ODAE LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000022046 OCVDAE LOOM
http://purl.bioontology.org/ontology/NDDF/006321 NDDF LOOM
http://purl.jp/bio/4/id/200906035911642764 IOBC LOOM
https://go.drugbank.com/drugs/DB01076 MDM LOOM
http://www.owl-ontologies.com/OntologyXCT.owl#Atorvastatin CTX LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C61527 NCIT LOOM
http://bmi.utah.edu/ontologies/peontology/C0286651 RAO LOOM
http://purl.bioontology.org/ontology/MESH/D000069059 MESH LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/373444002 SNOMEDCT LOOM