The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/dinto_DB03159 http://purl.obolibrary.org/obo/dinto_DB03159
Preferred Name	cra_8696
Synonyms	C21H17N3O 2-{5-[amino(iminiumyl)methyl]-1H-indol-2-yl}-6-phenylbenzen-1-olate
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	cra_8696
label	cra_8696
type	http://www.w3.org/2002/07/owl#Class
InChIKey	InChIKey=GAVRMVQHHVMXFD-UHFFFAOYSA-N
Synonym	C21H17N3O 2-{5-[amino(iminiumyl)methyl]-1H-indol-2-yl}-6-phenylbenzen-1-olate
xref	ChemSpider:394569 PubChem Substance:46508324 PubChem Compound:447476 PDB:696
prefixIRI	obo2:dinto_DB03159
related with	http://purl.obolibrary.org/obo/dinto_4072 http://purl.obolibrary.org/obo/dinto_1008 http://purl.obolibrary.org/obo/dinto_4048
SMILES	NC(=[NH2+])C1=CC=C2NC(=CC2=C1)C1=CC=CC(=C1[O-])C1=CC=CC=C1
InChI	InChI=1S/C21H17N3O/c22-21(23)14-9-10-18-15(11-14)12-19(24-18)17-8-4-7-16(20(17)25)13-5-2-1-3-6-13/h1-12,24-25H,(H3,22,23)
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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