MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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N-methyltyramine

	Properties	Image
MNX_ID	MNXM3670
reference	chebi:58155
formula	C₉H₁₄NO
global charge	1
mol weight	152.217
InChIKey	AXVZFRBSCNEKPQ-UHFFFAOYSA-O
InChI	InChI=1S/C9H13NO/c1-10-7-6-8-2-4-9(11)5-3-8/h2-5,10-11H,6-7H2,1H3/p+1
SMILES	C[NH2+]CCC1=CC=C(O)C=C1

MNX internals

InChI (mnx)	InChI=1/C9H13NO/c1-10-7-6-8-2-4-9(11)5-3-8/h2-5,10-11H,6-7H2,1H3
SMILES (mnx)	[CH3:1][NH:10][CH2:7][CH2:6][C:8]1=[CH:3][CH:5]=[C:9]([OH:11])[CH:4]=[CH:2]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	2

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58155 chebi:58155 AXVZFRBSCNEKPQ-UHFFFAOYSA-O	N-methyltyramine 2-(4-hydroxyphenyl)-N-methylethanaminium N-methyltyraminium N-methyltyraminium cation N-methyltyraminium(1+)
kegg.compound:C02442 keggC:C02442 AXVZFRBSCNEKPQ-UHFFFAOYSA-N	N-Methyltyramine
hmdb:HMDB0003633 AXVZFRBSCNEKPQ-UHFFFAOYSA-N	N-Methyltyramine 4-(2-(Methylamino)ethyl)-phenol 4-(2-Methylaminoethyl)phenol 4-Hydroxy-N-methylphenethylamine 4-[2-(Methylamino)ethyl]-phenol 4-[2-(Methylamino)ethyl]phenol 4-[2-(methylamino)ethyl]phenol Methyl tyramine Methyl-4-tyramine Methyl-4-tyramine hydrobromide Methyl-4-tyramine hydrochloride N-Methyl-p-tyramine N-Methyltyraminium N-Methyltyrosamine N-methyltyramine NMT p-(2-(Methylamino)ethyl)phenol p-(2-Methylaminoethyl)phenol p-[2-(Methylamino)ethyl]-phenol {p-[2-(methylamino)ethyl]phenol}
seed.compound:cpd01610 seedM:cpd01610 AXVZFRBSCNEKPQ-UHFFFAOYSA-O	N-Methyltyramine N-methyltyramine
metacyc.compound:CPD-391 metacycM:CPD-391 AXVZFRBSCNEKPQ-UHFFFAOYSA-O	N-methyltyramine
CHEBI:17458 chebi:17458 AXVZFRBSCNEKPQ-UHFFFAOYSA-N	N-methyltyramine 4-Hydroxy-N-methylphenethylamine 4-[2-(methylamino)ethyl]phenol Methyl-4-tyramine N-Methyltyramine p-(2-Methylaminoethyl)phenol
bigg.metabolite:C02442 biggM:C02442 AXVZFRBSCNEKPQ-UHFFFAOYSA-N	N-methyltyraminium
vmhM:C02442 vmhmetabolite:C02442 AXVZFRBSCNEKPQ-UHFFFAOYSA-O	N-methyltyraminium 4-[2-(methylamino)ethyl]phenol
hmdb:HMDB0060283 hmdb:HMDB0060284 hmdb:HMDB03633 hmdb:HMDB60283 hmdb:HMDB60284 chebi:12524 chebi:21775 chebi:7327 biggM:M_C02442 keggC:M_C02442 seedM:M_cpd01610 vmhM:M_C02442	secondary/obsolete/fantasy identifier