(-)-4'-methoxycyclopeptine

Properties Image MNX_ID MNXM164275 reference chebi:193537 formula C18H18N2O3 global charge 0 mol weight 310.353 InChIKey UOYDZPKQPOLDIR-INIZCTEOSA-N InChI InChI=1S/C18H18N2O3/c1-20-16(11-12-7-9-13(23-2)10-8-12)17(21)19-15-6-4-3-5-14(15)18(20)22/h3-10,16H,11H2,1-2H3,(H,19,21)/t16-/m0/s1 SMILES COC1=CC=C(C[C@H]2C(=O)NC3=C(C=CC=C3)C(=O)N2C)C=C1 MNX internals InChI (mnx) InChI=1/C18H18N2O3/c1-20-16(11-12-7-9-13(23-2)10-8-12)17(21)19-15-6-4-3-5-14(15)18(20)22/h3-10,16H,11H2,1-2H3,(H,19,21)/t16-/m0/s1 SMILES (mnx) [CH3:1][N:20]1[C@@H:16]([CH2:11][C:12]2=[CH:8][CH:10]=[C:13]([O:23][CH3:2])[CH:9]=[CH:7]2)[C:17]([OH:21])=[N:19][C:15]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:14]2[C:18]1=[O:22]

Parent-child relations graph

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