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

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N-isopropylammelide

	Properties	Image
MNX_ID	MNXM1102146
reference	chebi:17247
formula	C₆H₁₀N₄O₂
global charge	0
mol weight	170.172
InChIKey	DBFMBHXVWIURSV-UHFFFAOYSA-N
InChI	InChI=1S/C6H10N4O2/c1-3(2)7-4-8-5(11)10-6(12)9-4/h3H,1-2H3,(H3,7,8,9,10,11,12)
SMILES	CC(C)NC1=NC(O)=NC(O)=N1

MNX internals

InChI (mnx)	InChI=1/C6H10N4O2/c1-3(2)7-4-8-5(11)10-6(12)9-4/h3H,1-2H3,(H3,7,8,9,10,11,12)
SMILES (mnx)	[CH3:1][CH:3]([CH3:2])[N:7]=[C:4]1[N:8]=[C:5]([OH:11])[NH:10][C:6]([OH:12])=[N:9]1

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17247 chebi:17247 DBFMBHXVWIURSV-UHFFFAOYSA-N	N-isopropylammelide 6-(isopropylamino)-1,3,5-triazine-2,4-diol N-Isopropylammelide
envipath:...377a7f33ce2a envipathM:...377a7f33ce2a sabiork.compound:8721 sabiorkM:8721 kegg.compound:C06553 keggC:C06553 vmhM:nipamld vmhmetabolite:nipamld DBFMBHXVWIURSV-UHFFFAOYSA-N	N-Isopropylammelide
seed.compound:cpd03961 seedM:cpd03961 DBFMBHXVWIURSV-UHFFFAOYSA-N	N-Isopropylammelide 2,4-dihydroxy-6-(isopropylamino)-s-triazine 6-(isopropylamino)-1,3,5-triazine-2,4-diol N-isopropylammelide OOIT
metacyc.compound:N-ISOPROPYLAMMELIDE metacycM:N-ISOPROPYLAMMELIDE DBFMBHXVWIURSV-UHFFFAOYSA-N	N-isopropylammelide 2,4-dihydroxy-6-(isopropylamino)-s-triazine 6-(isopropylamino)-1,3,5-triazine-2,4-diol OOIT
envipath:...709ade694b85 envipathM:...709ade694b85 DBFMBHXVWIURSV-UHFFFAOYSA-N	compound 0054388
chebi:12603 chebi:21741 chebi:7300 keggC:M_C06553 seedM:M_cpd03961 vmhM:M_nipamld	secondary/obsolete/fantasy identifier