(2s)-6-amino-2-[[(2s)-2-[[(2s)-6-amino-2-[[(2s)-2-[[(2s)-2-[[(2s)-6-amino-2-[[(2s)-6-amino-2-[[(2s,3s)-2-[[(2s)-2-[[(2s)-6-amino-2-[[(2s)-2-[[2-[[(2s)-5-amino-2-[[(2s)-4-amino-2-[[(2s,3s)-2-[[(2s)-2-[[(2s)-2-[[2-[[(2s,3s)-2-[[(2s,3s)-2-[[(2s)-6-amino-2-[[(2s)-2-[[2-[[(2s)-1-[(2s)-2-[[(2s)-2-[[(2s)-2-[[(2s)-2-[[(2s)-2-[[2-[[(2s)-5-amino-2-[[(2s)-2-[[(2s,3r)-2-[[(2s)-5-amino-2-[[(2s,3s)-2-[[(2s)-2-[[(2s)-2,6-diaminohexanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]acetyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]hexanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-3-(1h-indol-3-yl)propanoyl]amino]hexanoic acid

Structural Information

Molecular Formula

C₁₈₄H₃₁₂N₅₂O₄₇

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C184H312N52O47/c1-27-98(16)145(234-180(279)149(102(20)31-5)233-162(261)118(62-42-49-79-190)211-151(250)103(21)205-135(242)89-203-171(270)130-65-52-82-236(130)182(281)107(25)209-174(273)143(96(12)13)228-153(252)106(24)207-173(272)144(97(14)15)229-176(275)142(95(10)11)227-138(245)92-201-156(255)120(66-70-131(193)238)212-152(251)104(22)208-181(280)150(108(26)237)235-165(264)122(68-72-133(195)240)220-177(276)146(99(17)28-2)230-154(253)105(23)206-155(254)112(192)56-37-44-74-185)172(271)204-90-136(243)210-129(87-140(248)249)170(269)215-119(64-51-81-199-184(197)198)163(262)231-148(101(19)30-4)179(278)225-128(86-134(196)241)169(268)216-121(67-71-132(194)239)157(256)202-91-137(244)226-141(94(8)9)175(274)218-116(60-40-47-77-188)159(258)217-123(69-73-139(246)247)164(263)232-147(100(18)29-3)178(277)219-117(61-41-48-78-189)158(257)213-114(58-38-45-75-186)160(259)223-126(84-109-53-33-32-34-54-109)167(266)222-125(83-93(6)7)166(265)214-115(59-39-46-76-187)161(260)224-127(85-110-88-200-113-57-36-35-55-111(110)113)168(267)221-124(183(282)283)63-43-50-80-191/h32-36,53-55,57,88,93-108,112,114-130,141-150,200,237H,27-31,37-52,56,58-87,89-92,185-192H2,1-26H3,(H2,193,238)(H2,194,239)(H2,195,240)(H2,196,241)(H,201,255)(H,202,256)(H,203,270)(H,204,271)(H,205,242)(H,206,254)(H,207,272)(H,208,280)(H,209,273)(H,210,243)(H,211,250)(H,212,251)(H,213,257)(H,214,265)(H,215,269)(H,216,268)(H,217,258)(H,218,274)(H,219,277)(H,220,276)(H,221,267)(H,222,266)(H,223,259)(H,224,260)(H,225,278)(H,226,244)(H,227,245)(H,228,252)(H,229,275)(H,230,253)(H,231,262)(H,232,263)(H,233,261)(H,234,279)(H,235,264)(H,246,247)(H,248,249)(H,282,283)(H4,197,198,199)/t98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108+,112-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-/m0/s1

InChIKey

KWCZSXMWUMHRTE-IRCPFGJUSA-N

Compound name

(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[2-[[(2S)-5-amino-2-[[(2S)-4-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S,3S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-5-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]acetyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]hexanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoic acid

Related CIDs

• CID 16130725