Molecular Formula: C64H56N4O10S4
Molecular weight: 1169.41024
InChi: InChI=1S/C60H48N4O8S4.C4H8O2/c65-53-33-69-57-45-25-41(37-13-5-1-6-14-37)26-46(57)74-48-28-43(39-17-9-3-10-18-39)30-50-59(48)71-35-55(67)63-24-23-62-54(66)34-70-58-47(73-45)27-42(38-15-7-2-8-16-38)29-49(58)75-51-31-44(40-19-11-4-12-20-40)32-52(76-50)60(51)72-36-56(68)64-22-21-61-53;1-3-6-4(2)5/h1-20,25-32H,21-24,33-36H2,(H,61,65)(H,62,66)(H,63,67)(H,64,68);3H2,1-2H3
InChi Key: CITKBLFRIUQRCH-UHFFFAOYSA-N
SMILES: O(C(=O)C)CC.c12c3c(Sc4c5c(Sc6c(c(Sc7c(c(S1)cc(c7)c1ccccc1)OCC(=O)NCCNC(=O)CO5)cc(c6)c1ccccc1)OCC(=O)NCCNC(=O)CO3)cc(c4)c1ccccc1)cc(c2)c1ccccc1