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

Structural Information

Molecular Formula

C₁₉₀H₂₉₉N₅₇O₆₂

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](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](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](C)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)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/C190H299N57O62/c1-24-87(9)146(245-174(296)114(44-35-73-208-190(203)204)222-154(276)94(16)213-153(275)93(15)221-175(297)127(77-102-45-47-105(250)48-46-102)240-172(294)121(55-65-140(261)262)224-156(278)96(18)212-149(271)89(11)211-150(272)90(12)216-160(282)111(41-32-70-205-187(197)198)226-180(302)131(81-144(269)270)242-178(300)128(78-103-82-209-108-38-28-26-36-106(103)108)239-159(281)99(21)219-163(285)118(52-62-137(255)256)233-177(299)129(79-104-83-210-109-39-29-27-37-107(104)109)243-185(307)148(101(23)249)247-182(304)145(196)100(22)248)184(306)236-120(54-64-139(259)260)164(286)220-98(20)158(280)238-126(75-85(5)6)181(303)246-147(88(10)25-2)183(305)235-112(42-33-71-206-188(199)200)161(283)217-91(13)151(273)214-95(17)155(277)223-115(49-59-133(192)251)167(289)231-123(57-67-142(265)266)171(293)229-116(50-60-134(193)252)168(290)228-117(51-61-135(194)253)169(291)232-122(56-66-141(263)264)170(292)225-110(40-30-31-69-191)166(288)241-130(80-136(195)254)179(301)234-119(53-63-138(257)258)162(284)218-92(14)152(274)215-97(19)157(279)237-125(74-84(3)4)176(298)227-113(43-34-72-207-189(201)202)165(287)230-124(58-68-143(267)268)173(295)244-132(186(308)309)76-86(7)8/h26-29,36-39,45-48,82-101,110-132,145-148,209-210,248-250H,24-25,30-35,40-44,49-81,191,196H2,1-23H3,(H2,192,251)(H2,193,252)(H2,194,253)(H2,195,254)(H,211,272)(H,212,271)(H,213,275)(H,214,273)(H,215,274)(H,216,282)(H,217,283)(H,218,284)(H,219,285)(H,220,286)(H,221,297)(H,222,276)(H,223,277)(H,224,278)(H,225,292)(H,226,302)(H,227,298)(H,228,290)(H,229,293)(H,230,287)(H,231,289)(H,232,291)(H,233,299)(H,234,301)(H,235,305)(H,236,306)(H,237,279)(H,238,280)(H,239,281)(H,240,294)(H,241,288)(H,242,300)(H,243,307)(H,244,295)(H,245,296)(H,246,303)(H,247,304)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,308,309)(H4,197,198,205)(H4,199,200,206)(H4,201,202,207)(H4,203,204,208)/t87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100+,101+,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,145-,146-,147-,148-/m0/s1

InChIKey

FMDMTNCPVSQHGC-ICOMKRHGSA-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)-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]propanoyl]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-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 16134184