Qiwnamawmewdreinnytslihslieesqnq

Structural Information

Molecular Formula

C₁₇₄H₂₅₇N₄₇O₅₅S₂

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](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)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/C174H257N47O55S2/c1-18-81(9)137(217-144(246)97(175)40-47-125(176)227)169(271)211-115(64-91-73-189-100-34-27-24-31-96(91)100)156(258)208-117(66-128(179)230)153(255)192-85(13)142(244)193-107(54-57-277-16)145(247)191-86(14)143(245)202-113(62-89-71-187-98-32-25-22-29-94(89)98)154(256)199-108(55-58-278-17)151(253)196-103(43-50-132(234)235)149(251)206-114(63-90-72-188-99-33-26-23-30-95(90)99)155(257)210-121(70-136(242)243)161(263)194-101(35-28-56-186-174(183)184)146(248)197-106(46-53-135(240)241)152(254)218-139(83(11)20-3)171(273)213-120(69-131(182)233)160(262)209-119(68-130(181)232)159(261)205-112(61-88-36-38-93(226)39-37-88)164(266)221-141(87(15)225)172(274)216-124(77-224)167(269)204-111(60-80(7)8)163(265)220-140(84(12)21-4)170(272)212-116(65-92-74-185-78-190-92)157(259)215-123(76-223)166(268)203-110(59-79(5)6)162(264)219-138(82(10)19-2)168(270)200-105(45-52-134(238)239)147(249)195-104(44-51-133(236)237)150(252)214-122(75-222)165(267)198-102(41-48-126(177)228)148(250)207-118(67-129(180)231)158(260)201-109(173(275)276)42-49-127(178)229/h22-27,29-34,36-39,71-74,78-87,97,101-124,137-141,187-189,222-226H,18-21,28,35,40-70,75-77,175H2,1-17H3,(H2,176,227)(H2,177,228)(H2,178,229)(H2,179,230)(H2,180,231)(H2,181,232)(H2,182,233)(H,185,190)(H,191,247)(H,192,255)(H,193,244)(H,194,263)(H,195,249)(H,196,253)(H,197,248)(H,198,267)(H,199,256)(H,200,270)(H,201,260)(H,202,245)(H,203,268)(H,204,269)(H,205,261)(H,206,251)(H,207,250)(H,208,258)(H,209,262)(H,210,257)(H,211,271)(H,212,272)(H,213,273)(H,214,252)(H,215,259)(H,216,274)(H,217,246)(H,218,254)(H,219,264)(H,220,265)(H,221,266)(H,234,235)(H,236,237)(H,238,239)(H,240,241)(H,242,243)(H,275,276)(H4,183,184,186)/t81-,82-,83-,84-,85-,86-,87+,97-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,137-,138-,139-,140-,141-/m0/s1

InChIKey

KXQAPNKDMHDSBN-SRVSMPANSA-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)-2-[[(2S)-2-[[(2S)-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]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]propanoyl]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 71598262