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

Structural Information

Molecular Formula

C₁₉₄H₃₀₇N₅₇O₆₅

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](CC1=CC=C(C=C1)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)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](CO)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](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/C194H307N57O65/c1-23-89(10)148(247-159(284)98(19)220-160(285)111(41-32-70-209-191(201)202)225-179(304)131(81-146(276)277)242-177(302)128(78-103-82-213-108-38-28-26-36-106(103)108)238-158(283)96(17)219-163(288)118(52-62-139(262)263)233-176(301)129(79-104-83-214-109-39-29-27-37-107(104)109)243-188(313)152(101(22)256)251-184(309)147(200)99(20)254)185(310)221-97(18)156(281)223-120(54-64-141(266)267)171(296)240-127(77-102-45-47-105(257)48-46-102)181(306)250-151(100(21)255)189(314)246-134(85-253)182(307)227-114(44-35-73-212-194(207)208)174(299)248-149(90(11)24-2)187(312)236-124(58-68-145(274)275)173(298)245-133(84-252)183(308)239-126(75-87(6)7)180(305)249-150(91(12)25-3)186(311)235-112(42-33-71-210-192(203)204)161(286)217-92(13)153(278)215-94(15)155(280)222-115(49-59-135(196)258)166(291)231-122(56-66-143(270)271)170(295)229-116(50-60-136(197)259)167(292)228-117(51-61-137(198)260)168(293)232-121(55-65-142(268)269)169(294)224-110(40-30-31-69-195)165(290)241-130(80-138(199)261)178(303)234-119(53-63-140(264)265)162(287)218-93(14)154(279)216-95(16)157(282)237-125(74-86(4)5)175(300)226-113(43-34-72-211-193(205)206)164(289)230-123(57-67-144(272)273)172(297)244-132(190(315)316)76-88(8)9/h26-29,36-39,45-48,82-83,86-101,110-134,147-152,213-214,252-257H,23-25,30-35,40-44,49-81,84-85,195,200H2,1-22H3,(H2,196,258)(H2,197,259)(H2,198,260)(H2,199,261)(H,215,278)(H,216,279)(H,217,286)(H,218,287)(H,219,288)(H,220,285)(H,221,310)(H,222,280)(H,223,281)(H,224,294)(H,225,304)(H,226,300)(H,227,307)(H,228,292)(H,229,295)(H,230,289)(H,231,291)(H,232,293)(H,233,301)(H,234,303)(H,235,311)(H,236,312)(H,237,282)(H,238,283)(H,239,308)(H,240,296)(H,241,290)(H,242,302)(H,243,313)(H,244,297)(H,245,298)(H,246,314)(H,247,284)(H,248,299)(H,249,305)(H,250,306)(H,251,309)(H,262,263)(H,264,265)(H,266,267)(H,268,269)(H,270,271)(H,272,273)(H,274,275)(H,276,277)(H,315,316)(H4,201,202,209)(H4,203,204,210)(H4,205,206,211)(H4,207,208,212)/t89-,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-,133-,134-,147-,148-,149-,150-,151-,152-/m0/s1

InChIKey

DQIHEOVUWWJIIS-AZSLJWGPSA-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,3R)-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,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]-3-methylpentanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]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 16134161