compound 0238505

Properties Image MNX_ID MNXM1179264 reference envipathM:...5c7a5df0a4cd formula C19H21NO4 global charge 0 mol weight 327.38 InChIKey ORBQQOPXFITZBJ-UHFFFAOYSA-N InChI InChI=1S/C19H21NO4/c1-2-16(22)19(14-9-5-3-6-10-14,15-11-7-4-8-12-15)17(23)18(20,24)13-21/h3-13,17,23-24H,2,20H2,1H3 SMILES CCC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C(O)C(N)(O)C=O MNX internals InChI (mnx) InChI=1/C19H21NO4/c1-2-16(22)19(14-9-5-3-6-10-14,15-11-7-4-8-12-15)17(23)18(20,24)13-21/h3-13,17,23-24H,2,20H2,1H3/t17?,18? SMILES (mnx) [CH3:1][CH2:2][C:16]([C:19]([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)[CH:17]([C:18]([CH:13]=[O:21])([NH2:20])[OH:24])[OH:23])=[O:22]

Parent-child relations graph

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