4'-O-methylnorbelladine (CHEBI:80667)

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ChEBI Name	4'-O-methylnorbelladine

ChEBI ID	CHEBI:80667

Definition	A phenethylamine alkaloid that is norbelladine in which the phenolic hydrogen at position 4' has been replaced by a methyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C16H19NO3

Net Charge

Average Mass

273.328

Monoisotopic Mass

273.13649

InChI

InChI=1S/C16H19NO3/c1-20-16-7-4-13(10-15(16)19)11-17-9-8-12-2-5-14(18)6-3-12/h2-7,10,17-19H,8-9,11H2,1H3

InChIKey

SDLILULALIDNSO-UHFFFAOYSA-N

SMILES

C1(=C(C=C(C=C1)CNCCC2=CC=C(C=C2)O)O)OC

Metabolite of Species	Details
Leucojum aestivum (NCBI:txid54835)	Found in stem (BTO:0001300). See: PubMed

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

ChEBI Ontology
Outgoing	4'-O-methylnorbelladine (CHEBI:80667) has functional parent norbelladine (CHEBI:80666) 4'-O-methylnorbelladine (CHEBI:80667) has role plant metabolite (CHEBI:76924) 4'-O-methylnorbelladine (CHEBI:80667) is a guaiacols (CHEBI:134251) 4'-O-methylnorbelladine (CHEBI:80667) is a phenethylamine alkaloid (CHEBI:38605) 4'-O-methylnorbelladine (CHEBI:80667) is a polyphenol (CHEBI:26195) 4'-O-methylnorbelladine (CHEBI:80667) is a secondary amino compound (CHEBI:50995) 4'-O-methylnorbelladine (CHEBI:80667) is conjugate base of 4'-O-methylnorbelladine(1+) (CHEBI:133993)

Incoming	4'-O-methylnorbelladine(1+) (CHEBI:133993) is conjugate acid of 4'-O-methylnorbelladine (CHEBI:80667)

IUPAC Name

5-({[2-(4-hydroxyphenyl)ethyl]amino}methyl)-2-methoxyphenol

Synonym	Source
N-isovanillyltyramine	ChEBI

Registry Number	Type	Source
2812972	Reaxys Registry Number	Reaxys

Last Modified

07 April 2017