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alpha-[3-[(Hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol

PropertiesImage
MNX_IDMNXM10645 Image of MNXM10645
referencechebi:82574
formulaC10H15N3O3
global charge0
mol weight225.248
InChIKeyUNFLQLWCJOTOPA-UHFFFAOYSA-N
InChIInChI=1S/C10H15N3O3/c14-8-13(12-16)6-2-4-10(15)9-3-1-5-11-7-9/h1,3,5,7,10,14-15H,2,4,6,8H2
SMILESO=NN(CO)CCCC(O)C1=CN=CC=C1
MNX internals
InChI (mnx)InChI=1/C10H15N3O3/c14-8-13(12-16)6-2-4-10(15)9-3-1-5-11-7-9/h1,3,5,7,10,14-15H,2,4,6,8H2/t10? Image of MNXM10645
SMILES (mnx)[CH:1]1=[CH:3][C:9]([CH:10]([CH2:4][CH2:2][CH2:6][N:13]([CH2:8][OH:14])[N:12]=[O:16])[OH:15])=[CH:7][N:11]=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd20834
seedM:cpd20834
CHEBI:82574
chebi:82574
kegg.compound:C19580
keggC:C19580
UNFLQLWCJOTOPA-UHFFFAOYSA-N
alpha-[3-[(Hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol

vmhM:M01320
vmhmetabolite:M01320
UNFLQLWCJOTOPA-UHFFFAOYSA-N
Alpha-[3-[(Hydroxymethyl)Nitrosoamino]Propyl]-3-Pyridinemethanol
4-[(hydroxymethyl)(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol
hmdb:HMDB0062444
UNFLQLWCJOTOPA-UHFFFAOYSA-N
alpha-[3-[(Hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol
4-[(hydroxymethyl)(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol
a-[3-[(Hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol
alpha-[3-[(hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol

hmdb:HMDB62444
keggC:M_C19580
seedM:M_cpd20834
vmhM:M_M01320
secondary/obsolete/fantasy identifier