compound 0238085

Properties Image MNX_ID MNXM1196240 reference envipathM:...66e15d7b65ff formula C19H20NO3 global charge -1 mol weight 310.373 InChIKey AFICCBXDIDORTG-UHFFFAOYSA-M InChI InChI=1S/C19H21NO3/c1-2-17(21)19(13-16(20)18(22)23,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16H,2,13,20H2,1H3,(H,22,23)/p-1 SMILES CCC(=O)C(CC(N)C(=O)[O-])(C1=CC=CC=C1)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C19H21NO3/c1-2-17(21)19(13-16(20)18(22)23,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16H,2,13,20H2,1H3,(H,22,23)/t16? SMILES (mnx) [CH3:1][CH2:2][C:17]([C:19]([CH2:13][CH:16]([C:18](=[O:22])[OH:23])[NH2:20])([C:14]1=[CH:9][CH:5]=[CH:3][CH:6]=[CH:10]1)[C:15]1=[CH:11][CH:7]=[CH:4][CH:8]=[CH:12]1)=[O:21]

Parent-child relations graph

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