Eledoisin trifluoroacetate

Iupac Name

(5S,8S,14S,17S,20S,23S)-23-((S)-6-amino-2-((S)-3-hydroxy-2-((S)-1-((S)-5-oxopyrrolidine-2-carbonyl)pyrrolidine-2-carboxamido)propanamido)hexanamido)-17-benzyl-14-((S)-sec-butyl)-5-carbamoyl-8-isobutyl-20-methyl-7,10,13,16,19,22-hexaoxo-2-thia-6,9,12,15,18,21-hexaazapentacosan-25-oic acid--2,2,2-trifluoroacetic acid (1/1)

Inchi Code

1S/C54H85N13O15S.C2HF3O2/c1-7-30(4)44(53(81)57-27-42(70)60-36(24-29(2)3)49(77)61-33(45(56)73)20-23-83-6)66-50(78)37(25-32-14-9-8-10-15-32)63-46(74)31(5)58-48(76)38(26-43(71)72)64-47(75)34(16-11-12-21-55)62-51(79)39(28-68)65-52(80)40-17-13-22-67(40)54(82)35-18-19-41(69)59-35;3-2(4,5)1(6)7/h8-10,14-15,29-31,33-40,44,68H,7,11-13,16-28,55H2,1-6H3,(H2,56,73)(H,57,81)(H,58,76)(H,59,69)(H,60,70)(H,61,77)(H,62,79)(H,63,74)(H,64,75)(H,65,80)(H,66,78)(H,71,72);(H,6,7)/t30-,31-,33-,34-,35-,36-,37-,38-,39-,40-,44-;/m0./s1

InChI key

LOHDZRQROMPBGG-JSMOHVFGSA-N