SMILES和InChIs
SMILES:
CC(C)C1C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)C(C)C)Cc1ccc(cc1)O)CO)Cc1cnc[nH]1)NC(=O)C)C(=O)N)CCCNC(=N)N
Canonical SMILES:
OCC1NC(=O)C(Cc2cnc[nH]2)NC(=O)C(CSSCC(NC(=O)C(CCCNC(=N)N)NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)CNC1=O)Cc1ccc(cc1)O)C(C)C)C(C)C)C(=O)N)NC(=O)C
InChI:
InChI=1S/C46H70N16O13S2/c1-22(2)36-44(74)53-17-35(67)61-37(23(3)4)45(75)57-28(7-6-12-51-46(48)49)40(70)60-32(38(47)68)19-76-77-20-33(55-24(5)64)43(73)58-30(14-26-15-50-21-54-26)41(71)59-31(18-63)39(69)52-16-34(66)56-29(42(72)62-36)13-25-8-10-27(65)11-9-25/h8-11,15,21-23,28-33,36-37,63,65H,6-7,12-14,16-20H2,1-5H3,(H2,47,68)(H,50,54)(H,52,69)(H,53,74)(H,55,64)(H,56,66)(H,57,75)(H,58,73)(H,59,71)(H,60,70)(H,61,67)(H,62,72)(H4,48,49,51)
InChIKey:
AXWMEVUCUFITEJ-UHFFFAOYSA-N