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

Structural Information

Molecular Formula

C₁₉₃H₃₀₅N₄₉O₆₂

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)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)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](CCCCN)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](CCCCN)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](CCCCN)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/C193H305N49O62/c1-25-93(10)152(239-165(275)105(22)213-166(276)116(46-32-37-75-194)220-186(296)137(87-150(264)265)236-184(294)134(84-109-88-204-114-44-30-28-42-112(109)114)233-164(274)103(20)211-169(279)124(58-68-143(250)251)227-183(293)135(85-110-89-205-115-45-31-29-43-113(110)115)237-192(302)155(107(24)244)242-188(298)151(203)106(23)243)189(299)215-104(21)161(271)218-127(61-71-146(256)257)178(288)234-133(83-108-51-53-111(245)54-52-108)181(291)214-98(15)158(268)206-99(16)159(269)216-120(50-36-41-79-198)180(290)240-153(94(11)26-2)191(301)230-126(60-70-145(254)255)170(280)212-102(19)163(273)232-132(81-91(6)7)187(297)241-154(95(12)27-3)190(300)229-117(47-33-38-76-195)167(277)209-96(13)156(266)207-100(17)160(270)217-121(55-65-139(199)246)173(283)225-129(63-73-148(260)261)177(287)223-122(56-66-140(200)247)174(284)222-123(57-67-141(201)248)175(285)226-128(62-72-147(258)259)176(286)219-119(49-35-40-78-197)172(282)235-136(86-142(202)249)185(295)228-125(59-69-144(252)253)168(278)210-97(14)157(267)208-101(18)162(272)231-131(80-90(4)5)182(292)221-118(48-34-39-77-196)171(281)224-130(64-74-149(262)263)179(289)238-138(193(303)304)82-92(8)9/h28-31,42-45,51-54,88-107,116-138,151-155,204-205,243-245H,25-27,32-41,46-50,55-87,194-198,203H2,1-24H3,(H2,199,246)(H2,200,247)(H2,201,248)(H2,202,249)(H,206,268)(H,207,266)(H,208,267)(H,209,277)(H,210,278)(H,211,279)(H,212,280)(H,213,276)(H,214,291)(H,215,299)(H,216,269)(H,217,270)(H,218,271)(H,219,286)(H,220,296)(H,221,292)(H,222,284)(H,223,287)(H,224,281)(H,225,283)(H,226,285)(H,227,293)(H,228,295)(H,229,300)(H,230,301)(H,231,272)(H,232,273)(H,233,274)(H,234,288)(H,235,282)(H,236,294)(H,237,302)(H,238,289)(H,239,275)(H,240,290)(H,241,297)(H,242,298)(H,250,251)(H,252,253)(H,254,255)(H,256,257)(H,258,259)(H,260,261)(H,262,263)(H,264,265)(H,303,304)/t93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106+,107+,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,151-,152-,153-,154-,155-/m0/s1

InChIKey

NQAGWNXZBWAMTL-OHFKQHLQSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-6-amino-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)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-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]hexanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]propanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]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]hexanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134153