Nh2-met-thr-trp-met-glu-trp-asp-arg-glu-ile-asn-asn-tyr-thr-ser-leu-ile-his-ser-leu-ile-glu-glu-ile-gln-asn-gln-gln-glu-lys-asn-glu-gln-glu-leu-leu-glu-leu-cooh

Structural Information

Molecular Formula

C₂₀₇H₃₂₀N₅₄O₇₀S₂

SMILES

CC[C@H](C)[C@@H](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](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)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](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)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](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCSC)N

InChI

InChI=1S/C207H320N54O70S2/c1-23-99(15)163(200(324)238-120(47-59-149(213)270)178(302)247-139(84-151(215)272)190(314)234-119(46-58-148(212)269)174(298)227-117(44-56-146(210)267)172(296)229-121(48-60-154(275)276)175(299)225-115(38-31-32-70-208)171(295)246-138(83-150(214)271)191(315)236-122(49-61-155(277)278)176(300)228-118(45-57-147(211)268)173(297)230-123(50-62-156(279)280)179(303)240-131(75-95(7)8)186(310)241-130(74-94(5)6)185(309)235-125(52-64-158(283)284)181(305)253-143(206(330)331)78-98(13)14)256-184(308)128(55-67-161(289)290)233-177(301)126(53-65-159(285)286)239-201(325)164(100(16)24-2)258-195(319)132(76-96(9)10)242-198(322)144(91-262)254-189(313)137(82-108-90-220-93-224-108)251-202(326)166(102(18)26-4)259-196(320)133(77-97(11)12)243-199(323)145(92-263)255-205(329)168(104(20)265)261-197(321)134(79-105-40-42-109(266)43-41-105)244-192(316)140(85-152(216)273)248-193(317)141(86-153(217)274)252-203(327)165(101(17)25-3)257-183(307)127(54-66-160(287)288)232-170(294)116(39-33-71-221-207(218)219)226-194(318)142(87-162(291)292)249-188(312)135(80-106-88-222-113-36-29-27-34-110(106)113)245-180(304)124(51-63-157(281)282)231-182(306)129(69-73-333-22)237-187(311)136(81-107-89-223-114-37-30-28-35-111(107)114)250-204(328)167(103(19)264)260-169(293)112(209)68-72-332-21/h27-30,34-37,40-43,88-90,93-104,112,115-145,163-168,222-223,262-266H,23-26,31-33,38-39,44-87,91-92,208-209H2,1-22H3,(H2,210,267)(H2,211,268)(H2,212,269)(H2,213,270)(H2,214,271)(H2,215,272)(H2,216,273)(H2,217,274)(H,220,224)(H,225,299)(H,226,318)(H,227,298)(H,228,300)(H,229,296)(H,230,297)(H,231,306)(H,232,294)(H,233,301)(H,234,314)(H,235,309)(H,236,315)(H,237,311)(H,238,324)(H,239,325)(H,240,303)(H,241,310)(H,242,322)(H,243,323)(H,244,316)(H,245,304)(H,246,295)(H,247,302)(H,248,317)(H,249,312)(H,250,328)(H,251,326)(H,252,327)(H,253,305)(H,254,313)(H,255,329)(H,256,308)(H,257,307)(H,258,319)(H,259,320)(H,260,293)(H,261,321)(H,275,276)(H,277,278)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H,330,331)(H4,218,219,221)/t99-,100-,101-,102-,103+,104+,112-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,163-,164-,165-,166-,167-,168-/m0/s1

InChIKey

OZXCMKWGUDMLKC-QQZPJSNSSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-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,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]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-oxobutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134220