About: ipratropium

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An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

cation

Attributes	Values
rdf:type	Item
description	cation (en) cation (fr) kation (pl)
rdfs:label	ipratropium (en) Ipratropium-Kation (de) ipratropium (fr) ipratropium (nn) ipratropium (pl) إبراتروبيوم (ar)
skos:prefLabel	ipratropium (en) Ipratropium-Kation (de) ipratropium (fr) ipratropium (nn) ipratropium (pl) إبراتروبيوم (ar)
name	ipratropium (en) Ipratropium-Kation (de) ipratropium (fr) ipratropium (nn) ipratropium (pl) إبراتروبيوم (ar)
isomeric SMILES	wds:Q23050139-126E2764-E290-495B-AF67-F3A01A0929CF
isomeric SMILES	CC(C)[N@+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2
subject has role	wds:Q23050139-01655AB7-B396-4042-BE02-BE476BEE8E58 wds:Q23050139-BDEBFE12-F3E1-49AE-B0FA-C04562F3CE75 wds:Q23050139-D4138B50-C4C6-4739-A327-DBE569D0658A
subject has role	bronchodilator anticholinergic muscarinic antagonist
chemical structure	wds:Q23050139-8ecf51ba-4b91-f1f8-3c85-c045bbab51e2
chemical structure
instance of	wds:Q23050139-0C1C4F6C-65DF-44A1-9026-A7C4A59A843D
instance of	type of chemical entity
subclass of	wds:Q23050139-03E38E3F-8984-4107-B0AF-E5B20D913307 wds:Q23050139-CC759585-9060-4211-A66E-63E7AFE95710
subclass of	cation (8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate
has use	wds:Q23050139-3AE7BA38-6920-498C-8215-7E5FEC547A31
has use	medication
Reaxys registry number	wds:Q23050139-1D120BC0-C64E-4EC6-BB9F-759E96CDD537
NDF-RT ID	wds:Q23050139-CA533417-F94A-4273-8C63-DDD7F6F9470C
CAS Registry Number	wds:Q23050139-dde8ba37-4e1a-9c4c-4f93-f8027636fd03
canonical SMILES	wds:Q23050139-3ECFEA77-2D5A-45AD-A9EE-9C6AF1773A77
InChI	wds:Q23050139-8DAF08D0-783F-4E3F-8D0B-9036A01EB0F6
InChIKey	wds:Q23050139-9BA1E637-D300-43F1-94A4-29B5D1B92892
chemical formula	wds:Q23050139-C2CC8BBD-07ED-450D-950A-F29D4878E7E1
DSSTox substance ID	wds:Q23050139-6D2B184F-419A-4259-BBF0-AD4237A24C8D
RxNorm ID	wds:Q23050139-5aa2aee5-499d-af2f-c076-1f29f8e4f23a
UNII	wds:Q23050139-3984e528-4493-3fa5-8d70-952c62a45a16
ChemSpider ID	wds:Q23050139-4485393E-D753-493E-8121-951ED452F449 wds:Q23050139-AB362BC6-E844-45CE-9248-96968145D334
KEGG ID	wds:Q23050139-30EC89AC-BD3F-44FE-B1D6-AE743EDD6D1B
ChEBI ID	wds:Q23050139-BB84C745-AE02-41A1-A407-6164824526EB
DrugBank ID	wds:Q23050139-202F8DB4-A2DD-4AEE-BF34-E725A6A70A53
DSSTOX compound identifier	wds:Q23050139-A58250B6-C55D-4531-BBA2-55BA96507AF6
NDF-RT ID	http://purl.bioontology.org/ontology/NDFRT/N0000147880
ChemSpider ID	http://rdf.chemspider.com/21234506 http://rdf.chemspider.com/3615
KEGG ID	http://www.kegg.jp/entry/C07052
ChEBI ID	http://purl.obolibrary.org/obo/CHEBI_5956
Reaxys registry number	5881723
NDF-RT ID	N0000147880
CAS Registry Number	60205-81-4
canonical SMILES	CC(C)[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C
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
chemical formula	C₂₀H₃₀NO₃⁺
DSSTox substance ID	DTXSID9048437
RxNorm ID	1546373
UNII	GR88G0I6UL
ChemSpider ID	3615 21234506
KEGG ID	C07052
ChEBI ID	5956
DrugBank ID	00332
DSSTOX compound identifier	DTXCID80809614
Commons category	wds:Q23050139-0bc8374a-4052-ccbc-648e-efca683bb1c2
Commons category	Ipratropium
skos:altLabel	kation ipratropiowy (pl)
mass	wds:Q23050139-3FABA49F-056B-4F01-AB9C-365847D6B711
MeSH descriptor ID	wds:Q23050139-315F5A13-F3C5-4E8D-976F-AF52FAFE2E57
MeSH tree code	wds:Q23050139-08a68803-4ec2-c086-47e7-c4b27a8f7f66 wds:Q23050139-2f0f8a92-4c20-1d23-4a40-b8a5d8f11cbf wds:Q23050139-612ea62b-4e10-4791-9dc7-807b65f5174f wds:Q23050139-7b57e573-431e-5db2-0f4a-4d4ee71e6b47 wds:Q23050139-9bed32d3-4d69-1178-fe6f-665855ddbf43
MeSH descriptor ID	http://id.nlm.nih.gov/mesh/D009241
MeSH tree code	http://id.nlm.nih.gov/mesh/D02.145.074.722.229.400 http://id.nlm.nih.gov/mesh/D03.132.760.180.572.400 http://id.nlm.nih.gov/mesh/D03.132.889.180.648.400 http://id.nlm.nih.gov/mesh/D03.605.084.500.722.229.400 http://id.nlm.nih.gov/mesh/D03.605.869.229.400
mass	332.222569 (xsd:decimal)
MeSH descriptor ID	D009241
MeSH tree code	D02.145.074.722.229.400 D03.132.760.180.572.400 D03.132.889.180.648.400 D03.605.084.500.722.229.400 D03.605.869.229.400

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