Chemical Name: (3S)-3-((R)-4-Amino-2-((S)-2-decanamido-3-(1H-indol-3-yl)propanamido)-4-oxobutanamido)-4-(((2R,5S,11R,14S,17S,20R,21S,27S,30S)-17-(2-(2-aminophenyl)-2-oxoethyl)-27-(3-aminopropyl)-5-(carboxymethyl)-14-((R)-1-carboxypropan-2-yl)-11-(hydroxymethyl)-2,20-dimethyl-3,6,9,12,15,18,22,25,28,32,33-undecaoxo-19-oxa-1,4,7,10,13,16,23,26,29-nonaazabicyclo[28.2.1]tritriacontan-21-yl)amino)-4-oxobutanoic acid
Smiles: O=C(N[C@H](CO)C(N[C@H](C(N[C@H](C(O[C@H](C)[C@@H](C(NCC(N[C@H]1CCCN)=O)=O)NC([C@H](CC(O)=O)NC([C@@H](CC(N)=O)NC([C@@H](NC(CCCCCCCCC)=O)CC2=CNC3=C2C=CC=C3)=O)=O)=O)=O)CC(C4=CC=CC=C4N)=O)=O)[C@H](C)CC(O)=O)=O)CNC([C@H](CC(O)=O)NC([C@@H](C)N5C([C@H](CC5=O)NC1=O)=O)=O)=O
Inchi: InChI=1S/C73H103N17O26/c1-5-7-8-9-10-11-12-23-54(94)81-45(26-38-32-77-43-21-16-14-18-39(38)43)66(108)84-46(28-53(76)93)67(109)87-49(31-60(103)104)69(111)90-62-37(4)116-73(115)50(27-52(92)40-19-13-15-20-41(40)75)88-72(114)61(36(3)25-57(97)98)89-70(112)51(35-91)82-56(96)33-78-63(105)47(29-58(99)100)85-64(106)42(6-2)83-68(110)48(30-59(101)102)86-65(107)44(22-17-24-74)80-55(95)34-79-71(62)113/h13-16,18-21,32,36-37,42,44-51,61-62,77,91H,5-12,17,22-31,33-35,74-75H2,1-4H3,(H2,76,93)(H,78,105)(H,79,113)(H,80,95)(H,81,94)(H,82,96)(H,83,110)(H,84,108)(H,85,106)(H,86,107)(H,87,109)(H,88,114)(H,89,112)(H,90,111)(H,97,98)(H,99,100)(H,101,102)(H,103,104)/t36-,37-,42?,44+,45+,46-,47+,48+,49+,50+,51-,61?,62+/m1/s1