Shkrkwaw

Structural Information

Molecular Formula

C₅₂H₇₅N₁₇O₁₀

SMILES

C[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@H](CO)N

InChI

InChI=1S/C52H75N17O10/c1-29(44(71)69-43(51(78)79)22-31-25-61-37-14-5-3-12-34(31)37)63-49(76)41(21-30-24-60-36-13-4-2-11-33(30)36)68-48(75)39(16-7-9-19-54)64-47(74)40(17-10-20-59-52(56)57)65-46(73)38(15-6-8-18-53)66-50(77)42(23-32-26-58-28-62-32)67-45(72)35(55)27-70/h2-5,11-14,24-26,28-29,35,38-43,60-61,70H,6-10,15-23,27,53-55H2,1H3,(H,58,62)(H,63,76)(H,64,74)(H,65,73)(H,66,77)(H,67,72)(H,68,75)(H,69,71)(H,78,79)(H4,56,57,59)/t29-,35-,38-,39-,40-,41-,42-,43-/m0/s1

InChIKey

FGHRTSICVWLCSV-WZULHDPSSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid

Related CIDs

• CID 6481233