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N-hydroxy-PhIP

PropertiesImage
MNX_IDMNXM101641 Image of MNXM101641
referencechebi:133920
formulaC13H12N4O
global charge0
mol weight240.266
InChIKeyDCVWQAGUQFBCTF-UHFFFAOYSA-N
InChIInChI=1S/C13H12N4O/c1-17-11-7-10(9-5-3-2-4-6-9)8-14-12(11)15-13(17)16-18/h2-8,18H,1H3,(H,14,15,16)
SMILESCN1C(NO)=NC2=C1C=C(C1=CC=CC=C1)C=N2
MNX internals
InChI (mnx)InChI=1/C13H12N4O/c1-17-11-7-10(9-5-3-2-4-6-9)8-14-12(11)15-13(17)16-18/h2-8,18H,1H3,(H,14,15,16) Image of MNXM101641
SMILES (mnx)[CH3:1][N:17]1[C:11]2=[C:12]([N:14]=[CH:8][C:10]([C:9]3=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]3)=[CH:7]2)[N:15]=[C:13]1[NH:16][OH:18]
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
IdentifierDescription

CHEBI:133920
chebi:133920
DCVWQAGUQFBCTF-UHFFFAOYSA-N 		N-hydroxy-PhIP
2-Hydroxyamino-PhIP
2-hydroxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine
N-(1-methyl-6-phenyl-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-ylidene)hydroxylamine
N-OH-PhIP

sabiork.compound:28737
sabiorkM:28737
DCVWQAGUQFBCTF-UHFFFAOYSA-N 		2-Hydroxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine

seed.compound:cpd31012
seedM:cpd31012
kegg.compound:C20286
keggC:C20286
DCVWQAGUQFBCTF-UHFFFAOYSA-N 		2-Hydroxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine
2-Hydroxyamino-PhIP
hmdb:HMDB0255150
DCVWQAGUQFBCTF-UHFFFAOYSA-N 		N-Hydroxy phip
2-Hydroxyamino-1-methyl-6-phenylimidazo(4,5-b)pyridine
2-Hydroxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine
2-Hydroxyamino-phip
N-Hydroxy-phip
N-OH-PhIP
N-{1-methyl-6-phenyl-1H-imidazo[4,5-b]pyridin-2-yl}hydroxylamine
N-{1-methyl-6-phenylimidazo[4,5-b]pyridin-2-yl}hydroxylamine

keggC:M_C20286
seedM:M_cpd31012 		secondary/obsolete/fantasy identifier