1-[[(2R,3R,4R)-1-acetyl-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-1-cyclopentyl-3-propan-2-ylurea

Properties Image MNX_ID MNXM341242 reference chebi:127870 formula C22H33N3O3 global charge 0 mol weight 387.524 InChIKey FQHHBQGTLDJKSJ-PCCBWWKXSA-N InChI InChI=1S/C22H33N3O3/c1-15(2)23-22(28)24(18-11-7-8-12-18)13-19-21(17-9-5-4-6-10-17)20(14-26)25(19)16(3)27/h4-6,9-10,15,18-21,26H,7-8,11-14H2,1-3H3,(H,23,28)/t19-,20-,21+/m0/s1 SMILES CC(=O)N1[C@@H](CO)[C@H](C2=CC=CC=C2)[C@@H]1CN(C(=O)NC(C)C)C1CCCC1 MNX internals InChI (mnx) InChI=1/C22H33N3O3/c1-15(2)23-22(28)24(18-11-7-8-12-18)13-19-21(17-9-5-4-6-10-17)20(14-26)25(19)16(3)27/h4-6,9-10,15,18-21,26H,7-8,11-14H2,1-3H3,(H,23,28)/t19-,20-,21+/m0/s1 SMILES (mnx) [CH3:1][CH:15]([CH3:2])[N:23]=[C:22]([N:24]([CH2:13][C@H:19]1[C@@H:21]([C:17]2=[CH:9][CH:5]=[CH:4][CH:6]=[CH:10]2)[C@H:20]([CH2:14][OH:26])[N:25]1[C:16]([CH3:3])=[O:27])[CH:18]1[CH2:11][CH2:7][CH2:8][CH2:12]1)[OH:28]

Parent-child relations graph

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