Chemical Name: 2,2'-((3S,6S,9R,15S,18R,21S,24S,30S,31R)-30-((S)-2-((R)-4-Amino-2-((S)-2-((E)-dec-8-enamido)-3-(1H-indol-3-yl)propanamido)-4-oxobutanamido)-3-carboxypropanamido)-3-(2-(2-aminophenyl)-2-oxoethyl)-24-(3-aminopropyl)-6-((R)-1-carboxypropan-2-yl)-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonaazacyclohentriacontane-15,21-diyl)diacetic acid
Smiles: NC1=CC=CC=C1C(C[C@@H](C(O[C@H](C)[C@@H](C(NC2)=O)NC([C@H](CC(O)=O)NC([C@H](NC([C@@H](NC(CCCCCC/C=C/C)=O)CC3=CNC4=C3C=CC=C4)=O)CC(N)=O)=O)=O)=O)NC([C@@H](NC([C@@H](CO)NC(CNC([C@H](CC(O)=O)NC([C@@H](C)NC([C@H](CC(O)=O)NC([C@H](CCCN)NC2=O)=O)=O)=O)=O)=O)=O)[C@H](C)CC(O)=O)=O)=O
Inchi: InChI=1S/C71H101N17O27/c1-5-6-7-8-9-10-11-22-52(93)80-42(25-49(90)37-17-12-14-19-39(37)73)65(108)83-43(27-51(75)92)66(109)85-46(30-58(102)103)67(110)88-60-36(4)115-71(114)47(26-50(91)38-18-13-15-20-40(38)74)86-70(113)59(34(2)24-55(96)97)87-68(111)48(33-89)81-54(95)31-76-62(105)44(28-56(98)99)82-61(104)35(3)78-64(107)45(29-57(100)101)84-63(106)41(21-16-23-72)79-53(94)32-77-69(60)112/h12-15,17-20,34-36,41-48,59-60,89H,5-11,16,21-33,72-74H2,1-4H3,(H2,75,92)(H,76,105)(H,77,112)(H,78,107)(H,79,94)(H,80,93)(H,81,95)(H,82,104)(H,83,108)(H,84,106)(H,85,109)(H,86,113)(H,87,111)(H,88,110)(H,96,97)(H,98,99)(H,100,101)(H,102,103)/t34-,35-,36-,41+,42+,43-,44+,45?,46+,47?,48-,59?,60+/m1/s1