compound 0060121

Properties Image MNX_ID MNXM1173559 reference envipathM:...d519c46f3337 formula C16H20N2O3 global charge 0 mol weight 288.347 InChIKey LDEYXRHPVNNNIL-UHFFFAOYSA-N InChI InChI=1S/C16H20N2O3/c1-16(17-2,12-8-9-14(20)18-15(12)21)10-13(19)11-6-4-3-5-7-11/h3-9,13,17,19H,10H2,1-2H3,(H2,18,20,21) SMILES CNC(C)(CC(O)C1=CC=CC=C1)C1=CC=C(O)N=C1O MNX internals InChI (mnx) InChI=1/C16H20N2O3/c1-16(17-2,12-8-9-14(20)18-15(12)21)10-13(19)11-6-4-3-5-7-11/h3-9,13,17,19H,10H2,1-2H3,(H2,18,20,21)/t13?,16? SMILES (mnx) [CH3:1][C:16]([CH2:10][CH:13]([C:11]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[OH:19])([C:12]1=[C:15]([OH:21])[N:18]=[C:14]([OH:20])[CH:9]=[CH:8]1)[NH:17][CH3:2]

Parent-child relations graph

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