Qiwnnatwmewdreinnytslihslieesqnq

Structural Information

Molecular Formula

C₁₇₄H₂₅₆N₄₈O₅₇S

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC7=CC=C(C=C7)O)C(=O)N[C@@H]([C@@H](C)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](CC8=CN=CN8)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](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CCC(=O)N)N

InChI

InChI=1S/C174H256N48O57S/c1-17-79(9)136(217-143(248)95(175)39-46-123(176)229)168(273)210-112(61-89-71-190-98-33-26-23-30-94(89)98)154(259)207-117(66-129(182)235)158(263)206-114(63-126(179)232)151(256)192-83(13)142(247)221-140(84(14)226)171(276)211-111(60-88-70-189-97-32-25-22-29-93(88)97)152(257)198-105(53-55-280-16)149(254)195-101(42-49-131(237)238)147(252)204-110(59-87-69-188-96-31-24-21-28-92(87)96)153(258)209-119(68-135(245)246)160(265)193-99(34-27-54-187-174(184)185)144(249)196-104(45-52-134(243)244)150(255)218-138(81(11)19-3)170(275)213-118(67-130(183)236)159(264)208-116(65-128(181)234)157(262)203-109(58-86-35-37-91(228)38-36-86)163(268)222-141(85(15)227)172(277)216-122(75-225)166(271)202-108(57-78(7)8)162(267)220-139(82(12)20-4)169(274)212-113(62-90-72-186-76-191-90)155(260)215-121(74-224)165(270)201-107(56-77(5)6)161(266)219-137(80(10)18-2)167(272)199-103(44-51-133(241)242)145(250)194-102(43-50-132(239)240)148(253)214-120(73-223)164(269)197-100(40-47-124(177)230)146(251)205-115(64-127(180)233)156(261)200-106(173(278)279)41-48-125(178)231/h21-26,28-33,35-38,69-72,76-85,95,99-122,136-141,188-190,223-228H,17-20,27,34,39-68,73-75,175H2,1-16H3,(H2,176,229)(H2,177,230)(H2,178,231)(H2,179,232)(H2,180,233)(H2,181,234)(H2,182,235)(H2,183,236)(H,186,191)(H,192,256)(H,193,265)(H,194,250)(H,195,254)(H,196,249)(H,197,269)(H,198,257)(H,199,272)(H,200,261)(H,201,270)(H,202,271)(H,203,262)(H,204,252)(H,205,251)(H,206,263)(H,207,259)(H,208,264)(H,209,258)(H,210,273)(H,211,276)(H,212,274)(H,213,275)(H,214,253)(H,215,260)(H,216,277)(H,217,248)(H,218,255)(H,219,266)(H,220,267)(H,221,247)(H,222,268)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,245,246)(H,278,279)(H4,184,185,187)/t79-,80-,81-,82-,83-,84+,85+,95-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,136-,137-,138-,139-,140-,141-/m0/s1

InChIKey

DLEOSGVAKLKUHN-HJZZGIKTSA-N

Compound name

(2S)-5-amino-2-[[(2S)-4-amino-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)-4-amino-2-[[(2S)-4-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoic acid

Related CIDs

• CID 71598260