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

Structural Information

Molecular Formula

C₁₉₂H₃₀₄N₅₈O₆₁

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=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](CCC(=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)N)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](CCC(=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](CCC(=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/C192H304N58O61/c1-25-88(10)147(247-160(282)100(22)221-161(283)112(43-34-70-208-189(200)201)228-181(303)132(82-145(271)272)244-178(300)128(78-104-83-212-109-40-30-28-38-107(104)109)240-159(281)98(20)219-164(286)119(54-63-139(259)260)234-177(299)129(79-105-84-213-110-41-31-29-39-108(105)110)245-187(309)150(102(24)252)250-183(305)146(199)101(23)251)184(306)223-99(21)156(278)226-122(57-66-142(265)266)172(294)241-127(77-103-47-49-106(253)50-48-103)175(297)222-93(15)153(275)214-94(16)154(276)224-115(46-37-73-211-192(206)207)174(296)248-148(89(11)26-2)186(308)237-121(56-65-141(263)264)165(287)220-97(19)158(280)239-126(75-86(6)7)182(304)249-149(90(12)27-3)185(307)236-113(44-35-71-209-190(202)203)162(284)217-91(13)151(273)215-95(17)155(277)225-116(51-60-134(194)254)171(293)243-131(81-138(198)258)179(301)233-118(53-62-136(196)256)169(291)230-117(52-61-135(195)255)168(290)232-123(58-67-143(267)268)170(292)227-111(42-32-33-69-193)167(289)242-130(80-137(197)257)180(302)235-120(55-64-140(261)262)163(285)218-92(14)152(274)216-96(18)157(279)238-125(74-85(4)5)176(298)229-114(45-36-72-210-191(204)205)166(288)231-124(59-68-144(269)270)173(295)246-133(188(310)311)76-87(8)9/h28-31,38-41,47-50,83-102,111-133,146-150,212-213,251-253H,25-27,32-37,42-46,51-82,193,199H2,1-24H3,(H2,194,254)(H2,195,255)(H2,196,256)(H2,197,257)(H2,198,258)(H,214,275)(H,215,273)(H,216,274)(H,217,284)(H,218,285)(H,219,286)(H,220,287)(H,221,283)(H,222,297)(H,223,306)(H,224,276)(H,225,277)(H,226,278)(H,227,292)(H,228,303)(H,229,298)(H,230,291)(H,231,288)(H,232,290)(H,233,301)(H,234,299)(H,235,302)(H,236,307)(H,237,308)(H,238,279)(H,239,280)(H,240,281)(H,241,294)(H,242,289)(H,243,293)(H,244,300)(H,245,309)(H,246,295)(H,247,282)(H,248,296)(H,249,304)(H,250,305)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,310,311)(H4,200,201,208)(H4,202,203,209)(H4,204,205,210)(H4,206,207,211)/t88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101+,102+,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,146-,147-,148-,149-,150-/m0/s1

InChIKey

JVFINAOFYQIDEH-GOAIDJCRSA-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)-4-amino-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]-4-carboxybutanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134162