The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/dinto_DB07401 http://purl.obolibrary.org/obo/dinto_DB07401
Preferred Name	methyl (2z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate
Synonyms	methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoate C22H17N3O5
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	methyl (2z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate
label	methyl (2z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate
type	http://www.w3.org/2002/07/owl#Class
InChIKey	InChIKey=WFDXOXNFNRHQEC-GHRIWEEISA-N
Synonym	methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoate C22H17N3O5
xref	ChemSpider:2298772 PDB:AZO PubChem Substance:99443872 PubChem Compound:3034285
prefixIRI	obo2:dinto_DB07401
related with	http://purl.obolibrary.org/obo/dinto_2695 http://purl.obolibrary.org/obo/dinto_2690 http://purl.obolibrary.org/obo/dinto_2694 http://purl.obolibrary.org/obo/dinto_2713 http://purl.obolibrary.org/obo/dinto_2022 http://purl.obolibrary.org/obo/dinto_3276 http://purl.obolibrary.org/obo/dinto_2702 http://purl.obolibrary.org/obo/dinto_2700 http://purl.obolibrary.org/obo/dinto_2706 http://purl.obolibrary.org/obo/dinto_2689 See more See less
SMILES	CO\C=C(\C(=O)OC)C1=CC=CC=C1OC1=NC=NC(OC2=CC=CC=C2C#N)=C1
InChI	InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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