compound 0051651

Properties Image MNX_ID MNXM1173365 reference envipathM:...acc99bec8032 formula C9H13N3O2 global charge 0 mol weight 195.222 InChIKey KLKDMFYKYCLJFQ-UHFFFAOYSA-N InChI InChI=1S/C9H13N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h6H,2-5H2,1H3,(H,10,12,13) SMILES COC(=O)NC1=NC2CCCCC2=N1 MNX internals InChI (mnx) InChI=1/C9H13N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h6H,2-5H2,1H3,(H,10,12,13)/t6? SMILES (mnx) [CH3:1][O:14][C:9](=[N:12][C:8]1=[N:10][CH:6]2[CH2:4][CH2:2][CH2:3][CH2:5][C:7]2=[N:11]1)[OH:13]

Parent-child relations graph

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