Wmewdreieelikkseelakkieeqakkqeesakk

Structural Information

Molecular Formula

C₁₉₀H₃₁₀N₅₀O₆₂S

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)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](CO)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](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H]([C@@H](C)CC)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@@H](C)CC)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/C190H310N50O62S/c1-15-98(8)152(187(299)229-128(61-73-148(259)260)171(283)221-121(54-66-141(245)246)168(280)218-119(52-64-139(200)243)159(271)207-101(11)155(267)210-111(43-22-30-77-191)160(272)214-114(46-25-33-80-194)162(274)219-120(53-65-140(201)244)167(279)220-122(55-67-142(247)248)169(281)224-127(60-72-147(257)258)176(288)236-137(94-241)184(296)209-103(13)157(269)212-113(45-24-32-79-193)165(277)231-132(189(301)302)50-29-37-84-198)238-178(290)117(49-28-36-83-197)216-161(273)112(44-23-31-78-192)211-156(268)102(12)208-180(292)133(87-96(4)5)232-173(285)124(57-69-144(251)252)222-170(282)123(56-68-143(249)250)227-185(297)138(95-242)237-166(278)115(47-26-34-81-195)215-163(275)116(48-27-35-82-196)228-186(298)154(100(10)17-3)240-183(295)134(88-97(6)7)233-174(286)125(58-70-145(253)254)223-172(284)129(62-74-149(261)262)230-188(300)153(99(9)16-2)239-179(291)130(63-75-150(263)264)226-164(276)118(51-38-85-204-190(202)203)217-182(294)136(91-151(265)266)235-181(293)135(90-105-93-206-110-42-21-19-40-107(105)110)234-175(287)126(59-71-146(255)256)225-177(289)131(76-86-303-14)213-158(270)108(199)89-104-92-205-109-41-20-18-39-106(104)109/h18-21,39-42,92-93,96-103,108,111-138,152-154,205-206,241-242H,15-17,22-38,43-91,94-95,191-199H2,1-14H3,(H2,200,243)(H2,201,244)(H,207,271)(H,208,292)(H,209,296)(H,210,267)(H,211,268)(H,212,269)(H,213,270)(H,214,272)(H,215,275)(H,216,273)(H,217,294)(H,218,280)(H,219,274)(H,220,279)(H,221,283)(H,222,282)(H,223,284)(H,224,281)(H,225,289)(H,226,276)(H,227,297)(H,228,298)(H,229,299)(H,230,300)(H,231,277)(H,232,285)(H,233,286)(H,234,287)(H,235,293)(H,236,288)(H,237,278)(H,238,290)(H,239,291)(H,240,295)(H,245,246)(H,247,248)(H,249,250)(H,251,252)(H,253,254)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,301,302)(H4,202,203,204)/t98-,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-,138-,152-,153-,154-/m0/s1

InChIKey

QBIHSKCHJHVZPB-NMICWOCKSA-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)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-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,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-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]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoic acid

Related CIDs

• CID 86574959