Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  Download |  REST API |  Citing RGD |  Contact   

CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:atorvastatin
go back to main search page
Accession:CHEBI:39548 term browser browse the term
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.
Synonyms:exact_synonym: (3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid
 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;   Atorlip;   Formula=C33H35FN2O5;   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;   SMILES=CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(O)=O;   atorvastatina;   atorvastatine;   atorvastatinum
 alt_id: CHEBI:2910;   CHEBI:39538
 xref: Beilstein:8373630;   CAS:134523-00-5;   DrugBank:DB01076;   Drug_Central:257;   HMDB:HMDB0005006;   KEGG:C06834;   KEGG:D07474;   LINCS:LSM-5771;   PDBeChem:117;   PMID:11693468;   PMID:15012735;   PMID:18720283;   Patent:EP409281;   Patent:US5273995;   Reaxys:8373630;   Wikipedia:Atorvastatin
 cyclic_relationship: is_conjugate_acid_of CHEBI:50690



show annotations for term's descendants           Sort by:
 
atorvastatin term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cdh1 cadherin 1 increases expression ISO atorvastatin co-treated with N-nitrosodiethylamine increases expression of Cdh1 mRNA in liver RGD PMID:25319454 RGD:152995431 NCBI chr19:34,492,371...34,561,775
Ensembl chr19:34,492,371...34,561,775
JBrowse link
G Slco1b2 solute carrier organic anion transporter family member 1B2 decreases expression ISO atorvastatin co-treated with N-nitrosodiethylamine decreases expression of Slco1b2 mRNA in liver RGD PMID:25319454 RGD:152995431 NCBI chr 4:174,551,463...174,619,988
Ensembl chr 4:174,551,480...174,619,981
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20072
    role 20026
      biological role 20025
        xenobiotic 18703
          atorvastatin 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 20072
    subatomic particle 20071
      composite particle 20071
        hadron 20071
          baryon 20071
            nucleon 20071
              atomic nucleus 20071
                atom 20071
                  main group element atom 19974
                    p-block element atom 19974
                      carbon group element atom 19903
                        carbon atom 19896
                          organic molecular entity 19896
                            organic group 18994
                              organic divalent group 18980
                                organodiyl group 18980
                                  carbonyl group 18933
                                    carbonyl compound 18933
                                      carboxylic acid 18629
                                        monocarboxylic acid 17867
                                          fatty acid 16492
                                            saturated fatty acid 16151
                                              straight-chain saturated fatty acid 15581
                                                heptanoic acid 610
                                                  atorvastatin 2
paths to the root