CHEBI:165202 - Fluvoxamino acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Fluvoxamino acid
ChEBI ID CHEBI:165202
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C14H17F3N2O3
Net Charge 0
Average Mass 318.296
Monoisotopic Mass 318.11913
InChI InChI=1S/C14H17F3N2O3/c15-14(16,17)11-6-4-10(5-7-11)12(19-22-9-8-18)2-1-3-13(20)21/h4-7H,1-3,8-9,18H2,(H,20,21)/b19-12+
InChIKey KUIZEDQDELAFQK-XDHOZWIPSA-N
SMILES FC(F)(F)C1=CC=C(\C(=N\OCCN)\CCCC(O)=O)C=C1
ChEBI Ontology
Outgoing Fluvoxamino acid (CHEBI:165202) is a (trifluoromethyl)benzenes (CHEBI:83565)
IUPAC Name
(5E)-5-(2-aminoethoxyimino)-5-[4-(triluoromethyl)phenyl]pentanoic acid
Manual Xrefs Databases
22547007 ChemSpider
HMDB0060950 HMDB
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Registry Number Type Source
84692-89-7 CAS Registry Number ChemIDplus