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

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4-aminoacetophenone

	Properties	Image
MNX_ID	MNXM151118
reference	metacycM:CPD-16769
formula	C₈H₉NO
global charge	0
mol weight	135.166
InChIKey	GPRYKVSEZCQIHD-UHFFFAOYSA-N
InChI	InChI=1S/C8H9NO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,9H2,1H3
SMILES	CC(=O)C1=CC=C(N)C=C1

MNX internals

InChI (mnx)	InChI=1/C8H9NO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,9H2,1H3
SMILES (mnx)	[CH3:1][C:6]([C:7]1=[CH:3][CH:5]=[C:8]([NH2:9])[CH:4]=[CH:2]1)=[O:10]

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-16769 metacycM:CPD-16769 GPRYKVSEZCQIHD-UHFFFAOYSA-N	4-aminoacetophenone 1-(4-aminophenyl)ethanone 4'-aminoacetophenone 4-acetylaniline ethanone, 1-(4-aminophenyl)- p-acetylaniline p-aminoacetophenone p-aminoacetylbenzene
seed.compound:cpd33950 seedM:cpd33950 GPRYKVSEZCQIHD-UHFFFAOYSA-N	1-(4-aminophenyl)ethanone 4'-aminoacetophenone 4-acetylaniline 4-aminoacetophenone ethanone, 1-(4-aminophenyl)- p-acetylaniline p-aminoacetophenone p-aminoacetylbenzene
sabiork.compound:27474 sabiorkM:27474 GPRYKVSEZCQIHD-UHFFFAOYSA-N	4-Aminoacetophenone
hmdb:HMDB0246623 GPRYKVSEZCQIHD-UHFFFAOYSA-N	4-Aminoacetophenone 1-(4-aminophenyl)ethan-1-one 4'-Aminoacetophenone 4-Acetylaniline 4-aminoacetophenone P-Acetylaniline P-Aminoacetophenone P-Aminoacetylbenzene Para-aminoacetophenone
seedM:M_cpd33950	secondary/obsolete/fantasy identifier