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

Structural Information

Molecular Formula

C₂₀₇H₃₃₂N₆₂O₆₁

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](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)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](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)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](CCC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C)NC(=O)[C@@H]6CCCN6

InChI

InChI=1S/C207H332N62O61/c1-20-102(10)164(267-193(317)134(62-74-155(219)277)251-180(304)126(50-38-86-228-206(223)224)245-183(307)130(58-70-151(215)273)254-196(320)142(91-112-52-54-115(270)55-53-112)263-182(306)125(48-31-36-84-212)244-186(310)132(60-72-153(217)275)257-204(328)166(104(12)22-3)268-192(316)133(61-73-154(218)276)240-168(292)105(13)235-177(301)135(63-75-159(281)282)255-197(321)143(92-113-97-230-118-42-25-23-40-116(113)118)259-171(295)109(17)234-176(300)122(45-28-33-81-209)246-198(322)144(93-114-98-231-119-43-26-24-41-117(114)119)264-200(324)146(95-157(221)279)261-172(296)107(15)232-174(298)120-49-37-85-227-120)202(326)237-110(18)169(293)241-136(64-76-160(283)284)190(314)262-141(89-100(6)7)201(325)269-165(103(11)21-2)203(327)238-111(19)173(297)260-145(94-156(220)278)194(318)236-106(14)167(291)239-123(46-29-34-82-210)178(302)243-124(47-30-35-83-211)179(303)248-128(56-68-149(213)271)184(308)249-129(57-69-150(214)272)185(309)253-137(65-77-161(285)286)188(312)250-131(59-71-152(216)274)189(313)265-147(96-158(222)280)199(323)256-138(66-78-162(287)288)187(311)242-121(44-27-32-80-208)175(299)233-108(16)170(294)258-140(88-99(4)5)195(319)247-127(51-39-87-229-207(225)226)181(305)252-139(67-79-163(289)290)191(315)266-148(205(329)330)90-101(8)9/h23-26,40-43,52-55,97-111,120-148,164-166,227,230-231,270H,20-22,27-39,44-51,56-96,208-212H2,1-19H3,(H2,213,271)(H2,214,272)(H2,215,273)(H2,216,274)(H2,217,275)(H2,218,276)(H2,219,277)(H2,220,278)(H2,221,279)(H2,222,280)(H,232,298)(H,233,299)(H,234,300)(H,235,301)(H,236,318)(H,237,326)(H,238,327)(H,239,291)(H,240,292)(H,241,293)(H,242,311)(H,243,302)(H,244,310)(H,245,307)(H,246,322)(H,247,319)(H,248,303)(H,249,308)(H,250,312)(H,251,304)(H,252,305)(H,253,309)(H,254,320)(H,255,321)(H,256,323)(H,257,328)(H,258,294)(H,259,295)(H,260,297)(H,261,296)(H,262,314)(H,263,306)(H,264,324)(H,265,313)(H,266,315)(H,267,317)(H,268,316)(H,269,325)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,329,330)(H4,223,224,228)(H4,225,226,229)/t102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,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-,146-,147-,148-,164-,165-,166-/m0/s1

InChIKey

NVGTUDLXXKKJTG-QAHCVSTISA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-4-oxo-2-[[(2S)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]butanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]propanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134207