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vanillylamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM6475

	#reac
in my sandbox	0
in MNXref (generic)	12
in models (compartimentalized)	0

formula

C₈H₁₂NO₂

charge

mass

154.08626

reference

InChIKey

WRPWWVNUCXQDQV-UHFFFAOYSA-O

InChI

InChI=1S/C8H11NO2/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,10H,5,9H2,1H3/p+1

SMILES

COc1cc(C[NH3+])ccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:149596 chebi:149596	vanillylamine (4-hydroxy-3-methoxyphenyl)methanaminium vanillylamine(1+)
kegg.compound:C16666 keggC:C16666	Vanillylamine
hmdb:HMDB0012309	Vanillylamine (3-Methoxy-4-hydroxyphenyl)methylamine (4-Hydroxy-3-methoxyphenyl)methanamine 3-Methoxy-4-hydroxybenzylamine 4-(aminomethyl)-2-methoxyphenol 4-Aminomethyl-2-methoxy-phenol 4-Hydroxy-3-methoxybenzylamine Vanillylamine hydrochloride a-Amino-2-methoxy-p-cresol alpha-Amino-2-methoxy-p-cresol vanillylamine
seed.compound:cpd16467 seedM:cpd16467	Vanillylamine capsaicin precursor vanillylamine
CHEBI:46958 chebi:46958	vanillylamine 4-(aminomethyl)-2-methoxyphenol 4-hydroxy-3-methoxybenzylamine
metacyc.compound:CPD-9327 metacycM:CPD-9327	vanillylamine capsaicin precursor
hmdb:HMDB12309 keggC:M_C16666 seedM:M_cpd16467	secondary/obsolete/fantasy identifier