CHEBI:31077 - 2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide

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ChEBI Name 2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide
ChEBI ID CHEBI:31077
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H18BrNO4
Net Charge 0
Average Mass 380.233
Monoisotopic Mass 379.04192
InChI InChI=1S/C17H18BrNO4/c1-19(8-7-11-3-5-12(20)6-4-11)17(22)13-9-15(21)16(23-2)10-14(13)18/h3-6,9-10,20-21H,7-8H2,1-2H3
InChIKey CRZBVPSGSPBXEZ-UHFFFAOYSA-N
SMILES COc1cc(Br)c(cc1O)C(=O)N(C)CCc1ccc(O)cc1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing 2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide (CHEBI:31077) is a alkaloid (CHEBI:22315)
Synonym Source
2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide KEGG COMPOUND
Manual Xref Database
C12252 KEGG COMPOUND
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Last Modified
28 July 2014