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

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diphenylamine

	Properties	Image
MNX_ID	MNXM17317
reference	chebi:4640
formula	C₁₂H₁₁N
global charge	0
mol weight	169.227
InChIKey	DMBHHRLKUKUOEG-UHFFFAOYSA-N
InChI	InChI=1S/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H
SMILES	C1=CC=C(NC2=CC=CC=C2)C=C1

MNX internals

InChI (mnx)	InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H
SMILES (mnx)	[CH:1]1=[CH:3][CH:7]=[C:11]([NH:13][C:12]2=[CH:9][CH:5]=[CH:2][CH:6]=[CH:10]2)[CH:8]=[CH:4]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
CHEBI:4640 chebi:4640 DMBHHRLKUKUOEG-UHFFFAOYSA-N	diphenylamine (phenylamino)benzene C6H5-NH-C6H5 DPA Diphenylamine N,N-diphenylamine N-phenylaniline N-phenylbenzenamine anilinobenzene
hmdb:HMDB0032562 DMBHHRLKUKUOEG-UHFFFAOYSA-N	Diphenylamine (Phenylamino)benzene (phenylamino)-Benzene 2-Biphenylyl-N-pyridyl-acetamide 2-Biphenylyl-N-pyridylacetamide Anilinobenzene Benzenamine, N-phenyl-, styrenated Big dipper C6H5-NH-C6H5 DFA DPA Deccoscald 282 Difenylamin Diphenpyramide Diphenyl-amine Diphenylamine indicator Diphenylamine, acs Diphenylamine, reaction product with 2,2,4-trimethylpentene N,N-Diphenylamine N-Fenylanilin N-Phenyl-aniline N-Phenyl-benzenamine N-Phenylbenzenamine N-Phenylbenzenamine, 9ci N-Phenylbenzenamine, styrenated N-Phenylbenzeneamine N-phenylaniline NO-Scald NO-Scald dpa 283 Naugalube 428l Phenylaniline Poly(diphenylamine) Pyridyl-biphenylyl-acetamide Scaldip Shield dpa Styrenated diphenylamine Styrene, reaction product with diphenylamine anilino-Benzene diphenylamine no Scald no Scald dpa 283
seed.compound:cpd07901 seedM:cpd07901 DMBHHRLKUKUOEG-UHFFFAOYSA-N	Diphenylamine DPA N,N-Diphenylamine diphenylamine
kegg.compound:C11016 keggC:C11016 DMBHHRLKUKUOEG-UHFFFAOYSA-N	Diphenylamine N,N-Diphenylamine
metacyc.compound:CPD-9937 metacycM:CPD-9937 DMBHHRLKUKUOEG-UHFFFAOYSA-N	diphenylamine DPA
hmdb:HMDB32562 keggC:M_C11016 seedM:M_cpd07901	secondary/obsolete/fantasy identifier