(-)-cyclopeptine

Properties Image MNX_ID MNXM104184 reference chebi:71333 formula C17H16N2O2 global charge 0 mol weight 280.327 InChIKey KSQNKZMAMGACTL-HNNXBMFYSA-N InChI InChI=1S/C17H16N2O2/c1-19-15(11-12-7-3-2-4-8-12)16(20)18-14-10-6-5-9-13(14)17(19)21/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1 SMILES CN1C(=O)C2=C(C=CC=C2)NC(=O)[C@@H]1CC1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C17H16N2O2/c1-19-15(11-12-7-3-2-4-8-12)16(20)18-14-10-6-5-9-13(14)17(19)21/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1 SMILES (mnx) [CH3:1][N:19]1[C@@H:15]([CH2:11][C:12]2=[CH:7][CH:3]=[CH:2][CH:4]=[CH:8]2)[C:16]([OH:20])=[N:18][C:14]2=[CH:10][CH:6]=[CH:5][CH:9]=[C:13]2[C:17]1=[O:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 2