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

Structural Information

Molecular Formula

C₂₀₁H₃₂₂N₆₀O₆₀S₂

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=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)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](CCCNC(=N)N)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](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)N

InChI

InChI=1S/C201H322N60O60S2/c1-25-98(12)156(193(317)231-107(21)162(286)233-119(44-34-76-218-197(208)209)168(292)228-104(18)161(285)235-124(53-63-144(204)263)175(299)244-131(60-70-152(275)276)179(303)242-125(54-64-145(205)264)176(300)241-126(55-65-146(206)265)177(301)245-130(59-69-151(273)274)178(302)237-118(43-32-33-75-202)173(297)256-141(90-147(207)266)189(313)247-127(56-66-148(267)268)169(293)227-101(15)159(283)225-102(16)164(288)250-135(83-94(4)5)186(310)239-122(47-37-79-221-200(214)215)172(296)243-133(62-72-154(279)280)182(306)258-143(196(320)321)86-97(10)11)261-192(316)137(85-96(8)9)254-180(304)129(58-68-150(271)272)236-163(287)108(22)232-194(318)157(99(13)26-2)260-191(315)136(84-95(6)7)253-174(298)120(45-35-77-219-198(210)211)234-160(284)105(19)230-185(309)138(87-109-49-51-112(262)52-50-109)251-166(290)106(20)229-170(294)128(57-67-149(269)270)249-195(319)158(100(14)27-3)259-184(308)123(48-38-80-222-201(216)217)238-171(295)121(46-36-78-220-199(212)213)240-190(314)142(91-155(281)282)257-188(312)140(89-111-93-224-117-42-31-29-40-114(111)117)255-181(305)132(61-71-153(277)278)246-183(307)134(74-82-323-24)248-187(311)139(88-110-92-223-116-41-30-28-39-113(110)116)252-165(289)103(17)226-167(291)115(203)73-81-322-23/h28-31,39-42,49-52,92-108,115,118-143,156-158,223-224,262H,25-27,32-38,43-48,53-91,202-203H2,1-24H3,(H2,204,263)(H2,205,264)(H2,206,265)(H2,207,266)(H,225,283)(H,226,291)(H,227,293)(H,228,292)(H,229,294)(H,230,309)(H,231,317)(H,232,318)(H,233,286)(H,234,284)(H,235,285)(H,236,287)(H,237,302)(H,238,295)(H,239,310)(H,240,314)(H,241,300)(H,242,303)(H,243,296)(H,244,299)(H,245,301)(H,246,307)(H,247,313)(H,248,311)(H,249,319)(H,250,288)(H,251,290)(H,252,289)(H,253,298)(H,254,304)(H,255,305)(H,256,297)(H,257,312)(H,258,306)(H,259,308)(H,260,315)(H,261,316)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,279,280)(H,281,282)(H,320,321)(H4,208,209,218)(H4,210,211,219)(H4,212,213,220)(H4,214,215,221)(H4,216,217,222)/t98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,115-,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-,156-,157-,158-/m0/s1

InChIKey

NZOTWBKCZAIUGW-UVSWVYHLSA-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)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]propanoyl]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]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]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 16134190