Gigavlkvlttkiwsilaplgrkrqq(nh2)

Structural Information

Molecular Formula

C₁₃₁H₂₂₉N₃₉O₃₁

SMILES

CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N)NC(=O)CN

InChI

InChI=1S/C131H229N39O31/c1-23-71(16)102(163-97(176)60-135)122(194)147-62-98(177)148-74(19)108(180)164-100(69(12)13)123(195)158-90(57-67(8)9)117(189)154-84(40-29-32-50-133)114(186)165-101(70(14)15)124(196)159-91(58-68(10)11)119(191)168-106(77(22)173)128(200)169-105(76(21)172)127(199)156-85(41-30-33-51-134)115(187)166-103(72(17)24-2)126(198)161-92(59-78-61-145-80-38-27-26-37-79(78)80)118(190)162-93(64-171)120(192)167-104(73(18)25-3)125(197)160-89(56-66(6)7)116(188)149-75(20)129(201)170-54-36-44-94(170)121(193)157-88(55-65(4)5)109(181)146-63-99(178)150-82(42-34-52-143-130(139)140)110(182)152-83(39-28-31-49-132)111(183)153-86(43-35-53-144-131(141)142)112(184)155-87(46-48-96(137)175)113(185)151-81(107(138)179)45-47-95(136)174/h26-27,37-38,61,65-77,81-94,100-106,145,171-173H,23-25,28-36,39-60,62-64,132-135H2,1-22H3,(H2,136,174)(H2,137,175)(H2,138,179)(H,146,181)(H,147,194)(H,148,177)(H,149,188)(H,150,178)(H,151,185)(H,152,182)(H,153,183)(H,154,189)(H,155,184)(H,156,199)(H,157,193)(H,158,195)(H,159,196)(H,160,197)(H,161,198)(H,162,190)(H,163,176)(H,164,180)(H,165,186)(H,166,187)(H,167,192)(H,168,191)(H,169,200)(H4,139,140,143)(H4,141,142,144)/t71-,72-,73-,74-,75-,76+,77+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,100-,101-,102-,103-,104-,105-,106-/m0/s1

InChIKey

MSMPXZMSGCZSAR-JFTDCZMZSA-N

Compound name

(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S,3S)-2-[(2-aminoacetyl)amino]-3-methylpentanoyl]amino]acetyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-oxopentanoyl]amino]pentanediamide

Related CIDs

• CID 16130192