Kpvslsyrccryslsvpk

Structural Information

Molecular Formula

C₉₂H₁₅₂N₂₆O₂₅S₂

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCCN)N

InChI

InChI=1S/C92H152N26O25S2/c1-47(2)37-59(106-81(133)65(43-121)112-87(139)71(49(5)6)115-86(138)70-22-15-35-117(70)88(140)55(95)17-9-11-31-93)75(127)109-64(42-120)80(132)108-61(39-51-23-27-53(123)28-24-51)77(129)102-57(20-14-34-101-92(98)99)74(126)113-68(46-145)84(136)114-67(45-144)83(135)103-56(19-13-33-100-91(96)97)73(125)107-62(40-52-25-29-54(124)30-26-52)78(130)110-63(41-119)79(131)105-60(38-48(3)4)76(128)111-66(44-122)82(134)116-72(50(7)8)89(141)118-36-16-21-69(118)85(137)104-58(90(142)143)18-10-12-32-94/h23-30,47-50,55-72,119-124,144-145H,9-22,31-46,93-95H2,1-8H3,(H,102,129)(H,103,135)(H,104,137)(H,105,131)(H,106,133)(H,107,125)(H,108,132)(H,109,127)(H,110,130)(H,111,128)(H,112,139)(H,113,126)(H,114,136)(H,115,138)(H,116,134)(H,142,143)(H4,96,97,100)(H4,98,99,101)/t55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-/m0/s1

InChIKey

GSRGGILMYSNWNK-NSKYRFEWSA-N

Compound name

(2S)-6-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-carbamimidamido-2-[[(2R)-2-[[(2R)-2-[[(2S)-5-carbamimidamido-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2,6-diaminohexanoyl]pyrrolidine-2-carbonyl]amino]-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-sulfanylpropanoyl]amino]-3-sulfanylpropanoyl]amino]pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid

Related CIDs

• CID 16133597