desbutyl-lumefantrine

Properties Image MNX_ID MNXM155172 reference hmdb:HMDB0061083 formula C26H24Cl3NO global charge 0 mol weight 472.843 InChIKey YLBUTQNEBVPTES-NHDPSOOVSA-N InChI InChI=1S/C26H24Cl3NO/c1-2-3-10-30-15-25(31)24-14-19(29)13-23-21(11-16-4-6-17(27)7-5-16)22-12-18(28)8-9-20(22)26(23)24/h4-9,11-14,25,30-31H,2-3,10,15H2,1H3/b21-11- SMILES CCCCNCC(O)C1=CC(Cl)=CC2=C1C1=C(C=C(Cl)C=C1)/C2=C/C1=CC=C(Cl)C=C1 MNX internals InChI (mnx) InChI=1/C26H24Cl3NO/c1-2-3-10-30-15-25(31)24-14-19(29)13-23-21(11-16-4-6-17(27)7-5-16)22-12-18(28)8-9-20(22)26(23)24/h4-9,11-14,25,30-31H,2-3,10,15H2,1H3/b21-11-/t25? SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:10][NH:30][CH2:15][CH:25]([C:24]1=[CH:14][C:19]([Cl:29])=[CH:13][C:23]2=[C:26]1[C:20]1=[C:22]([CH:12]=[C:18]([Cl:28])[CH:8]=[CH:9]1)/[C:21]2=[CH:11]/[C:16]1=[CH:5][CH:7]=[C:17]([Cl:27])[CH:6]=[CH:4]1)[OH:31]

Parent-child relations graph

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