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

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2-phenylacetamide

	Properties	Image
MNX_ID	MNXM2073
reference	chebi:16562
formula	C₈H₉NO
global charge	0
mol weight	135.166
InChIKey	LSBDFXRDZJMBSC-UHFFFAOYSA-N
InChI	InChI=1S/C8H9NO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)
SMILES	NC(=O)CC1=CC=CC=C1

MNX internals

InChI (mnx)	InChI=1/C8H9NO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:7]([CH2:6][C:8](=[NH:9])[OH:10])[CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	5

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16562 chebi:16562 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-phenylacetamide 2-Phenylacetamide alpha-phenylacetamide alpha-toluamide benzeneacetamide phenyl-beta-acetylamine phenylacetamide phenylacetic acid amide
bigg.metabolite:pad biggM:pad	2 Phenylacetamide
bigg.metabolite:M00673 biggM:M00673 sabiork.compound:6244 sabiorkM:6244 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-Phenylacetamide
hmdb:HMDB0010715 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-Phenylacetamide (alpha-)2-Phenylacetamide 2-Phenyl-acetamide 2-phenylacetamide Benzeneacetamide Phenyl-b-acetylamine Phenyl-beta-acetylamine Phenylacetamide Phenylacetate amide Phenylacetic acid amide a-Phenylacetamide a-Toluamide alpha-Phenylacetamide alpha-Toluamide alpha-Toluimidic acid alpha-phenylacetamide alpha-toluamide beta-Phenyl-acetylamine phenylacetamide
seed.compound:cpd01647 seedM:cpd01647 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-Phenylacetamide 2-acetanilide 2-phenylacetamide N-phenylacetamide acetanilide alpha-Phenylacetamide pad phenylacetamide
vmhM:M00673 vmhmetabolite:M00673 vmhM:pad vmhmetabolite:pad LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-Phenylacetamide 2-phenylacetamide
kegg.compound:C02505 keggC:C02505 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-Phenylacetamide alpha-Phenylacetamide
metacyc.compound:CPD-238 metacycM:CPD-238 LSBDFXRDZJMBSC-UHFFFAOYSA-N	2-phenylacetamide 2-acetanilide N-phenylacetamide acetanilide phenylacetamide
envipath:...3b0bf390f137 envipathM:...3b0bf390f137 LSBDFXRDZJMBSC-UHFFFAOYSA-N	Phenylacetamide
hmdb:HMDB10715 chebi:11647 chebi:1264 chebi:19762 chebi:25974 biggM:M_M00673 biggM:M_pad keggC:M_C02505 seedM:M_cpd01647 vmhM:M_M00673 vmhM:M_pad	secondary/obsolete/fantasy identifier