Wmewdreaeelakkaeelakkaeelakkqeelakk

Structural Information

Molecular Formula

C₁₈₅H₃₀₁N₄₉O₅₉S

SMILES

C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C185H301N49O59S/c1-93(2)84-132(178(286)204-100(12)150(258)208-113(44-23-31-76-188)161(269)216-111(42-21-29-74-186)159(267)202-98(10)155(263)213-122(54-65-141(240)241)169(277)224-126(58-69-145(248)249)173(281)231-134(86-95(5)6)180(288)206-102(14)152(260)210-115(46-25-33-78-190)163(271)218-117(48-27-35-80-192)164(272)220-119(51-62-138(195)235)167(275)222-124(56-67-143(244)245)171(279)226-128(60-71-147(252)253)175(283)232-135(87-96(7)8)181(289)207-103(15)153(261)211-116(47-26-34-79-191)166(274)228-131(184(292)293)49-28-36-81-193)229-172(280)125(57-68-144(246)247)223-168(276)121(53-64-140(238)239)212-154(262)97(9)201-158(266)112(43-22-30-75-187)217-162(270)114(45-24-32-77-189)209-151(259)101(13)205-179(287)133(85-94(3)4)230-174(282)127(59-70-146(250)251)225-170(278)123(55-66-142(242)243)214-156(264)99(11)203-160(268)120(52-63-139(236)237)221-165(273)118(50-37-82-198-185(196)197)219-183(291)137(90-149(256)257)234-182(290)136(89-105-92-200-110-41-20-18-39-107(105)110)233-176(284)129(61-72-148(254)255)227-177(285)130(73-83-294-16)215-157(265)108(194)88-104-91-199-109-40-19-17-38-106(104)109/h17-20,38-41,91-103,108,111-137,199-200H,21-37,42-90,186-194H2,1-16H3,(H2,195,235)(H,201,266)(H,202,267)(H,203,268)(H,204,286)(H,205,287)(H,206,288)(H,207,289)(H,208,258)(H,209,259)(H,210,260)(H,211,261)(H,212,262)(H,213,263)(H,214,264)(H,215,265)(H,216,269)(H,217,270)(H,218,271)(H,219,291)(H,220,272)(H,221,273)(H,222,275)(H,223,276)(H,224,277)(H,225,278)(H,226,279)(H,227,285)(H,228,274)(H,229,280)(H,230,282)(H,231,281)(H,232,283)(H,233,284)(H,234,290)(H,236,237)(H,238,239)(H,240,241)(H,242,243)(H,244,245)(H,246,247)(H,248,249)(H,250,251)(H,252,253)(H,254,255)(H,256,257)(H,292,293)(H4,196,197,198)/t97-,98-,99-,100-,101-,102-,103-,108-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-/m0/s1

InChIKey

QOKZOSLEOGGCBY-KJHSSDLYSA-N

Compound name

(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoic acid

Related CIDs

• CID 86574957