**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

doxylamine

Properties Image MNX_ID MNXM51595 reference chebi:51380 formula C17H22N2O global charge 0 mol weight 270.376 InChIKey HCFDWZZGGLSKEP-UHFFFAOYSA-N InChI InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3 SMILES CN(C)CCOC(C)(c1ccccc1)c1ccccn1 MNX internals InChI (mnx) InChI=1/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3/t17? SMILES (mnx) [CH3:1][C:17]([c:15]1[cH:9][cH:5][cH:4][cH:6][cH:10]1)([c:16]1[cH:11][cH:7][cH:8][cH:12][n:18]1)[O:20][CH2:14][CH2:13][N:19]([CH3:2])[CH3:3]

Parent-child relations graph

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

Similar chemical compounds in external resources

Identifier	Description
CHEBI:51380 chebi:51380 HCFDWZZGGLSKEP-UHFFFAOYSA-N	doxylamine 2-(alpha-(2-(Dimethylamino)ethoxy)-alpha-methylbenzyl)pyridine 2-Dimethylaminoethoxyphenylmethyl-2-picoline Dossilamina Doxilminio N,N-Dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)ethanamine N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine Phenyl-2-pyridylmethyl-beta-N,N-dimethylaminoethyl ether doxilamina doxylaminum
vmhM:doxl vmhM:doxl vmhmetabolite:doxl vmhmetabolite:doxl HCFDWZZGGLSKEP-UHFFFAOYSA-O	Doxylamine
kegg.drug:D07878 keggD:D07878 HCFDWZZGGLSKEP-UHFFFAOYSA-N	Doxylamine (INN)
hmdb:HMDB0001936 HCFDWZZGGLSKEP-UHFFFAOYSA-N	Doxylamine 2-(a-(2-(Dimethylamino)ethoxy)-a-methylbenzyl)pyridine 2-(alpha-(2-(Dimethylamino)ethoxy)-alpha-methylbenzyl)pyridine 2-(alpha-(2-(dimethylamino)ethoxy)-alpha-methylbenzyl)pyridine 2-Dimethylaminoethoxyphenylmethyl-2-picoline Alsadorm Decapryn Decapryn succinate Dossilamina Doxilamina Doxilminio Doxylamine hydrogen succinate Doxylamine succinate Doxylamine succinate (1:1) Doxylaminum Mereprine N,N-Dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)ethanamine Phenyl-2-pyridylmethyl-b-N,N-dimethylaminoethyl ether Phenyl-2-pyridylmethyl-beta-N,N-dimethylaminoethyl ether dimethyl({2-[1-phenyl-1-(pyridin-2-yl)ethoxy]ethyl})amine doxylamine
hmdb:HMDB01936 keggD:M_D07878 vmhM:M_doxl	secondary/obsolete/fantasy identifier