lissoclibadin 3

Properties Image MNX_ID MNXM106241 reference chebi:66581 formula C26H38N2O4S4 global charge 0 mol weight 570.868 InChIKey DDNBLGHDDGIIFX-UHFFFAOYSA-N InChI InChI=1S/C26H38N2O4S4/c1-27(2)13-11-15-21(33-9)17(29-5)19(31-7)25-23(15)35-26-20(32-8)18(30-6)22(34-10)16(24(26)36-25)12-14-28(3)4/h11-14H2,1-10H3 SMILES COC1=C(OC)C2=C(SC3=C(S2)C(CCN(C)C)=C(SC)C(OC)=C3OC)C(CCN(C)C)=C1SC MNX internals InChI (mnx) InChI=1/C26H38N2O4S4/c1-27(2)13-11-15-21(33-9)17(29-5)19(31-7)25-23(15)35-26-20(32-8)18(30-6)22(34-10)16(24(26)36-25)12-14-28(3)4/h11-14H2,1-10H3 SMILES (mnx) [CH3:1][N:27]([CH3:2])[CH2:13][CH2:11][C:15]1=[C:21]([S:33][CH3:9])[C:17]([O:29][CH3:5])=[C:19]([O:31][CH3:7])[C:25]2=[C:23]1[S:35][C:26]1=[C:20]([O:32][CH3:8])[C:18]([O:30][CH3:6])=[C:22]([S:34][CH3:10])[C:16]([CH2:12][CH2:14][N:28]([CH3:3])[CH3:4])=[C:24]1[S:36]2

Parent-child relations graph

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