Biological and Environmental Research Ontology

Last uploaded: December 23, 2022
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Preferred Name

pitavastatin calcium
Synonyms

Pitavastatin hemicalcium

Bis((3R,5S,6E)-7-(2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl)-3,5-dihydroxy-6-heptenoate) monocalcium salt

calcium bis{(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate}
Definitions

The calcium salt of pitavastatin. Used for treatment of hypercholesterolemia (elevated levels of cholesterol in the blood) on patients unable to sufficiently lower their cholesterol levels by diet and exercise.
ID

http://purl.obolibrary.org/obo/CHEBI_71258
alternative term

Pitavastatin hemicalcium

Bis((3R,5S,6E)-7-(2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl)-3,5-dihydroxy-6-heptenoate) monocalcium salt

calcium bis{(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate}
bearer of

http://purl.obolibrary.org/obo/CHEBI_22586
charge

0
database_cross_reference

Patent:US2011319624

Patent:WO2007125547

Patent:WO2007132482

PMID:20621877

Patent:KR20110097058

Patent:WO2005063711

PMID:21069103

Patent:US2012016129

PMID:21651447

PMID:21816477

Patent:WO2012025939

Patent:KR20110092804

Patent:EP2383260

PMID:21225019

PMID:20664824

KEGG:D01862

Patent:US2011082298

PMID:20852754

Patent:WO2012002741

Patent:US2012101126

PMID:21381428

Wikipedia:Pitavastatin

Patent:US2009182008

CAS:147526-32-7

Reaxys:7965530

Patent:WO2011105649
definition

The calcium salt of pitavastatin. Used for treatment of hypercholesterolemia (elevated levels of cholesterol in the blood) on patients unable to sufficiently lower their cholesterol levels by diet and exercise.
formula

C50H46CaF2N2O8
has part

http://purl.obolibrary.org/obo/CHEBI_71260
has_exact_synonym

calcium bis{(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate}
has_obo_namespace

chebi_ontology
has_related_synonym

Pitavastatin hemicalcium

Bis((3R,5S,6E)-7-(2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl)-3,5-dihydroxy-6-heptenoate) monocalcium salt
id

CHEBI:71258
in_subset

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

InChI=1S/2C25H24FNO4.Ca/c2*26-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)27-25(16-5-6-16)21(24)12-11-18(28)13-19(29)14-23(30)31;/h2*1-4,7-12,16,18-19,28-29H,5-6,13-14H2,(H,30,31);/q;;+2/p-2/b2*12-11+;/t2*18-,19-;/m11./s1
inchikey

RHGYHLPFVJEAOC-FFNUKLMVSA-L
label

pitavastatin calcium
mass

880.98400
monoisotopicmass

880.28481
notation

CHEBI:71258
overlaps

http://purl.obolibrary.org/obo/CHEBI_71260
prefLabel

pitavastatin calcium
RO_0000087

http://purl.obolibrary.org/obo/CHEBI_22586
smiles

[Ca++].O[C@H](C[C@H](O)\C=C\c1c(nc2ccccc2c1-c1ccc(F)cc1)C1CC1)CC([O-])=O.O[C@H](C[C@H](O)\C=C\c1c(nc2ccccc2c1-c1ccc(F)cc1)C1CC1)CC([O-])=O
subClassOf

http://purl.obolibrary.org/obo/CHEBI_35156

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