Benzyl 2-({[4-(carbamimidamidomethyl)cyclohexyl]carbonyl}oxy)benzoate

Properties Image MNX_ID MNXM103015 reference chebi:177854 formula C23H27N3O4 global charge 0 mol weight 409.486 InChIKey IAXUQWSLRKIRFR-UHFFFAOYSA-N InChI InChI=1S/C23H27N3O4/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2,(H4,24,25,26) SMILES NC(N)=NCC1CCC(C(=O)OC2=CC=CC=C2C(=O)OCC2=CC=CC=C2)CC1 MNX internals InChI (mnx) InChI=1/C23H27N3O4/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2,(H4,24,25,26)/t16?,18? SMILES (mnx) [CH:1]1=[CH:2][CH:6]=[C:17]([CH2:15][O:29][C:22]([C:19]2=[CH:8][CH:4]=[CH:5][CH:9]=[C:20]2[O:30][C:21]([CH:18]2[CH2:12][CH2:10][CH:16]([CH2:14][NH:26][C:23](=[NH:24])[NH2:25])[CH2:11][CH2:13]2)=[O:27])=[O:28])[CH:7]=[CH:3]1

Parent-child relations graph

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