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

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auramine O

	Properties	Image
MNX_ID	MNXM102919
reference	chebi:51876
formula	C₁₇H₂₂ClN₃
global charge	0
mol weight	303.837
InChIKey	KSCQDDRPFHTIRL-UHFFFAOYSA-N
InChI	InChI=1S/C17H21N3.ClH/c1-19(2)15-9-5-13(6-10-15)17(18)14-7-11-16(12-8-14)20(3)4;/h5-12,18H,1-4H3;1H
SMILES	CN(C)C1=CC=C(C(=N)C2=CC=C(N(C)C)C=C2)C=C1.Cl

MNX internals

InChI (mnx)	InChI=1/C17H21N3.ClH/c1-19(2)15-9-5-13(6-10-15)17(18)14-7-11-16(12-8-14)20(3)4;/h5-12,18H,1-4H3;1H
SMILES (mnx)	[CH3:1][N:19]([CH3:2])[C:15]1=[CH:10][CH:6]=[C:13]([C:17]([C:14]2=[CH:8][CH:12]=[C:16]([N:20]([CH3:3])[CH3:4])[CH:11]=[CH:7]2)=[NH:18])[CH:5]=[CH:9]1.[ClH:21]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:51876 chebi:51876 KSCQDDRPFHTIRL-UHFFFAOYSA-N	auramine O (Tetramethyldiamino)diphenylketoimine hydrochloride 1,1-Bis(p-dimethylaminophenyl)methylenimine hydrochloride 4,4'-(Imidocarbonyl)bis(N,N-dimethylamine), monohydrochloride 4,4'-Bis(dimethylamino)-benzhydrylidenimine hydrochloride 4,4'-carbonimidoylbis(N,N-dimethylaniline) hydrochloride 4:4'-Bis(dimethylamino)benzophenone-imine hydrochloride Auramin Auramine Yellow Basic yellow 2 C.I. 41000 C.I. Basic Yellow 2 C.I. Basic Yellow 2, monohydrochloride bis[4-(dimethylamino)phenyl]methaniminium chloride