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

Feedback

Wurster's blue

	Properties	Image
MNX_ID	MNXM1132302
reference	metacycM:CPD-23205
formula	C₁₀H₁₆N₂
global charge	0
mol weight	164.252
InChIKey	CJAOGUFAAWZWNI-UHFFFAOYSA-N
InChI	InChI=1S/C10H16N2/c1-11(2)9-5-7-10(8-6-9)12(3)4/h5-8H,1-4H3
SMILES	CN(C)C1=CC=C(N(C)C)C=C1

MNX internals

InChI (mnx)	InChI=1/C10H16N2/c1-11(2)9-5-7-10(8-6-9)12(3)4/h5-8H,1-4H3
SMILES (mnx)	[CH3:1][N:11]([CH3:2])[C:9]1=[CH:6][CH:8]=[C:10]([N:12]([CH3:3])[CH3:4])[CH:7]=[CH:5]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-23205 metacycM:CPD-23205 CJAOGUFAAWZWNI-UHFFFAOYSA-N	Wurster's blue N,N,N',N'-tetramethyl-p-phenylenediamine TMPD
hmdb:HMDB0244279 CJAOGUFAAWZWNI-UHFFFAOYSA-N	N,N,N',N'-Tetramethyl-P-phenylenediamine Blue, wurster Blue, wurster's N1,N1,N4,N4-tetramethylbenzene-1,4-diamine Reagent, wurster's Tetramethylphenylenediamine Wurster blue Wurster reagent Wurster's blue Wurster's reagent Wursters blue Wursters reagent wurster's blue
sabiork.compound:32145 sabiorkM:32145 CJAOGUFAAWZWNI-UHFFFAOYSA-N	N,N,N',N'-Tetramethyl-p-phenylenediamine TMPD