Nh2-thr-thr-trp-asp-ala-trp-asp-arg-ala-ile-ala-asp-tyr-ala-ala-arg-ile-asp-ala-leu-ile-arg-ala-ala-gln-asp-gln-gln-glu-lys-asn-asp-ala-ala-leu-arg-glu-leu-cooh

Structural Information

Molecular Formula

C₁₈₈H₂₉₅N₅₇O₆₂

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)N

InChI

InChI=1S/C188H295N57O62/c1-25-84(10)143(242-156(278)96(22)213-157(279)108(43-34-62-203-185(195)196)222-175(297)128(78-141(267)268)238-172(294)120(70-100-79-207-105-40-30-28-38-103(100)105)231-154(276)94(20)216-169(291)123(73-136(257)258)236-173(295)121(71-101-80-208-106-41-31-29-39-104(101)106)239-183(305)146(98(24)247)245-179(301)142(194)97(23)246)180(302)218-95(21)155(277)232-126(76-139(263)264)177(299)233-119(69-99-47-49-102(248)50-48-99)167(289)214-88(14)148(270)209-90(16)150(272)219-111(46-37-65-206-188(201)202)166(288)243-145(86(12)27-3)182(304)240-125(75-138(261)262)170(292)217-93(19)153(275)230-118(67-82(6)7)178(300)244-144(85(11)26-2)181(303)228-109(44-35-63-204-186(197)198)158(280)212-87(13)147(269)210-91(17)151(273)220-112(51-56-130(190)249)164(286)235-127(77-140(265)266)176(298)227-114(53-58-132(192)251)162(284)224-113(52-57-131(191)250)161(283)226-115(54-59-134(253)254)163(285)221-107(42-32-33-61-189)160(282)234-122(72-133(193)252)174(296)237-124(74-137(259)260)168(290)215-89(15)149(271)211-92(18)152(274)229-117(66-81(4)5)171(293)223-110(45-36-64-205-187(199)200)159(281)225-116(55-60-135(255)256)165(287)241-129(184(306)307)68-83(8)9/h28-31,38-41,47-50,79-98,107-129,142-146,207-208,246-248H,25-27,32-37,42-46,51-78,189,194H2,1-24H3,(H2,190,249)(H2,191,250)(H2,192,251)(H2,193,252)(H,209,270)(H,210,269)(H,211,271)(H,212,280)(H,213,279)(H,214,289)(H,215,290)(H,216,291)(H,217,292)(H,218,302)(H,219,272)(H,220,273)(H,221,285)(H,222,297)(H,223,293)(H,224,284)(H,225,281)(H,226,283)(H,227,298)(H,228,303)(H,229,274)(H,230,275)(H,231,276)(H,232,277)(H,233,299)(H,234,282)(H,235,286)(H,236,295)(H,237,296)(H,238,294)(H,239,305)(H,240,304)(H,241,287)(H,242,278)(H,243,288)(H,244,300)(H,245,301)(H,253,254)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,306,307)(H4,195,196,203)(H4,197,198,204)(H4,199,200,205)(H4,201,202,206)/t84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97+,98+,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,142-,143-,144-,145-,146-/m0/s1

InChIKey

XQSXKEIQIFLZSK-YDMLUPNYSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-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,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-3-carboxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134193