Ac-pipihycapa gfailkcnnk tfngtgp-nh2

Structural Information

Molecular Formula

C₁₃₂H₂₀₁N₃₅O₃₄S₂

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CC(=O)N)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N6CCC[C@H]6C(=O)N)NC(=O)[C@@H]7CCCN7C(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H]8CCCN8C(=O)C

InChI

InChI=1S/C132H201N35O34S2/c1-15-68(6)104(128(197)154-84(52-67(4)5)116(185)148-82(36-24-26-46-133)113(182)157-93(65-203)123(192)153-91(59-100(137)174)121(190)152-90(58-99(136)173)120(189)149-83(37-25-27-47-134)114(183)163-108(75(13)169)130(199)155-87(54-78-34-22-19-23-35-78)117(186)151-89(57-98(135)172)112(181)141-62-102(176)159-107(74(12)168)127(196)142-63-103(177)165-49-28-38-94(165)109(138)178)160-111(180)72(10)144-115(184)85(53-77-32-20-18-21-33-77)147-101(175)61-140-110(179)71(9)145-124(193)96-40-30-50-166(96)131(200)73(11)146-122(191)92(64-202)158-118(187)86(55-79-42-44-81(171)45-43-79)150-119(188)88(56-80-60-139-66-143-80)156-129(198)105(69(7)16-2)161-126(195)97-41-31-51-167(97)132(201)106(70(8)17-3)162-125(194)95-39-29-48-164(95)76(14)170/h18-23,32-35,42-45,60,66-75,82-97,104-108,168-169,171,202-203H,15-17,24-31,36-41,46-59,61-65,133-134H2,1-14H3,(H2,135,172)(H2,136,173)(H2,137,174)(H2,138,178)(H,139,143)(H,140,179)(H,141,181)(H,142,196)(H,144,184)(H,145,193)(H,146,191)(H,147,175)(H,148,185)(H,149,189)(H,150,188)(H,151,186)(H,152,190)(H,153,192)(H,154,197)(H,155,199)(H,156,198)(H,157,182)(H,158,187)(H,159,176)(H,160,180)(H,161,195)(H,162,194)(H,163,183)/t68-,69-,70-,71-,72-,73-,74+,75+,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,104-,105-,106-,107-,108-/m0/s1

InChIKey

UMBJKHFAZJJAIB-IWRUBBRTSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S,3S)-2-[[(2S)-1-acetylpyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-sulfanylpropanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-6-aminohexanoyl]amino]-3-sulfanylpropanoyl]amino]-4-amino-4-oxobutanoyl]amino]-4-amino-4-oxobutanoyl]amino]-6-aminohexanoyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-N-[2-[[(2S,3R)-1-[[2-[(2S)-2-carbamoylpyrrolidin-1-yl]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-2-oxoethyl]butanediamide

Related CIDs

• CID 16204867