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

Structural Information

Molecular Formula

C₂₀₉H₃₃₅N₅₉O₆₇

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

InChI

InChI=1S/C209H335N59O67/c1-18-104(10)165(265-172(300)110(16)235-175(303)127(50-37-87-227-207(221)222)243-200(328)148(98-164(295)296)262-197(325)144(94-113-99-230-119-42-23-21-40-116(113)119)259-191(319)137(65-77-160(287)288)247-180(308)124(47-28-34-84-213)241-196(324)145(95-114-100-231-120-43-24-22-41-117(114)120)263-205(333)168(111(17)269)268-173(301)118(216)57-71-154(275)276)202(330)254-139(67-79-162(291)292)186(314)251-136(64-76-159(285)286)190(318)258-143(93-112-53-55-115(270)56-54-112)195(323)240-123(46-27-33-83-212)178(306)237-122(45-26-32-82-211)177(305)239-129(52-39-89-229-209(225)226)193(321)266-166(105(11)19-2)204(332)255-140(68-80-163(293)294)187(315)250-135(63-75-158(283)284)189(317)257-142(91-102(6)7)201(329)267-167(106(12)20-3)203(331)253-121(44-25-31-81-210)174(302)233-107(13)169(297)232-108(14)170(298)236-133(61-73-156(279)280)188(316)261-147(97-153(220)274)199(327)252-131(59-70-151(218)272)184(312)245-130(58-69-150(217)271)183(311)249-134(62-74-157(281)282)185(313)238-126(49-30-36-86-215)182(310)260-146(96-152(219)273)198(326)242-125(48-29-35-85-214)179(307)246-132(60-72-155(277)278)176(304)234-109(15)171(299)256-141(90-101(4)5)194(322)244-128(51-38-88-228-208(223)224)181(309)248-138(66-78-161(289)290)192(320)264-149(206(334)335)92-103(8)9/h21-24,40-43,53-56,99-111,118,121-149,165-168,230-231,269-270H,18-20,25-39,44-52,57-98,210-216H2,1-17H3,(H2,217,271)(H2,218,272)(H2,219,273)(H2,220,274)(H,232,297)(H,233,302)(H,234,304)(H,235,303)(H,236,298)(H,237,306)(H,238,313)(H,239,305)(H,240,323)(H,241,324)(H,242,326)(H,243,328)(H,244,322)(H,245,312)(H,246,307)(H,247,308)(H,248,309)(H,249,311)(H,250,315)(H,251,314)(H,252,327)(H,253,331)(H,254,330)(H,255,332)(H,256,299)(H,257,317)(H,258,318)(H,259,319)(H,260,310)(H,261,316)(H,262,325)(H,263,333)(H,264,320)(H,265,300)(H,266,321)(H,267,329)(H,268,301)(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,293,294)(H,295,296)(H,334,335)(H4,221,222,227)(H4,223,224,228)(H4,225,226,229)/t104-,105-,106-,107-,108-,109-,110-,111+,118-,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-,146-,147-,148-,149-,165-,166-,167-,168-/m0/s1

InChIKey

LOYURABTIBXAMJ-OBENJWGDSA-N

Compound name

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

Related CIDs

• CID 16134189