Biological and Environmental Research Ontology

Last uploaded: December 23, 2022
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Preferred Name

ipratropium
Synonyms

Ipratropium

(3-endo,8-syn)-3-[(3-hydroxy-2-phenylpropanoyl)oxy]-8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octane
ID

http://purl.obolibrary.org/obo/CHEBI_5956
charge

+1
database_cross_reference

CAS:60205-81-4

KEGG:C07052

Beilstein:10733804

Beilstein:5881723
formula

C20H30NO3
has_exact_synonym

Ipratropium

(3-endo,8-syn)-3-[(3-hydroxy-2-phenylpropanoyl)oxy]-8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octane
has_obo_namespace

chebi_ontology
id

CHEBI:5956
in_subset

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

InChI=1S/C20H30NO3/c1-14(2)21(3)16-9-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-5-4-6-8-15/h4-8,14,16-19,22H,9-13H2,1-3H3/q+1/t16-,17+,18+,19?,21+
inchikey

OEXHQOGQTVQTAT-JRNQLAHRSA-N
label

ipratropium
mass

332.45714
monoisotopicmass

332.22202
notation

CHEBI:5956
prefLabel

ipratropium
smiles

[H][C@]12CC[C@]([H])(C[C@@H](C1)OC(=O)C(CO)c1ccccc1)[N@+]2(C)C(C)C
subClassOf

http://purl.obolibrary.org/obo/CHEBI_37332

http://purl.obolibrary.org/obo/CHEBI_36243

http://purl.obolibrary.org/obo/CHEBI_35267
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http://purl.obolibrary.org/obo/CHEBI_5956 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_5956 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_5956 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_5956 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_5956 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_5956 CHEBI LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.605.869.229.400 RH-MESH LOOM
http://purl.bioontology.org/ontology/LNC/LP171404-9 LOINC LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C61794 NCIT LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.145.074.722.229.400 RH-MESH LOOM
http://purl.obolibrary.org/obo/CHEBI_5956 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_5956 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_5956 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_5956 NIFSTD LOOM
http://stirdf.jst.go.jp/id/200907031897122505 IOBC LOOM
http://purl.jp/bio/4/id/200906020559646846 IOBC LOOM
http://webprotege.stanford.edu/RVFEUadsAUZ817OCqcy0HV COPDO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D009241 RH-MESH LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#8455 OCHV LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147880 NDFRT LOOM
http://purl.bioontology.org/ontology/VANDF/4019791 VANDF LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0027235 OCHV LOOM
http://purl.bioontology.org/ontology/RXNORM/7213 RXNORM LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016242 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372518007 SNOMEDCT LOOM
http://purl.obolibrary.org/obo/OMIT_0010276 OMIT LOOM
http://purl.bioontology.org/ontology/NDDF/004943 NDDF LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.132.760.180.572.400 RH-MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D04.075.080.875.099.722.229.400 RH-MESH LOOM
https://go.drugbank.com/drugs/DB00332 MDM LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.132.889.180.648.400 RH-MESH LOOM
http://purl.bioontology.org/ontology/RCD/x01Db RCD LOOM
http://purl.bioontology.org/ontology/MESH/D009241 MESH LOOM