Shiva-10

Structural Information

Molecular Formula

C₁₂₃H₂₂₆N₃₂O₂₄

SMILES

C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C123H226N32O24/c1-70(2)62-94(117(172)139-82(20)106(161)155-100(123(178)179)68-76(13)14)149-105(160)81(19)138-121(176)95(63-71(3)4)150-112(167)88(47-27-36-56-127)143-104(159)80(18)137-120(175)97(65-73(7)8)152-114(169)91(50-30-39-59-130)145-109(164)86(45-25-34-54-125)141-102(157)78(16)136-119(174)98(66-74(9)10)153-115(170)92(51-31-40-60-131)147-111(166)89(48-28-37-57-128)148-122(177)99(67-75(11)12)154-116(171)93(52-32-41-61-132)146-110(165)87(46-26-35-55-126)142-103(158)79(17)135-118(173)96(64-72(5)6)151-113(168)90(49-29-38-58-129)144-108(163)85(44-24-33-53-124)140-101(156)77(15)134-107(162)84(133)69-83-42-22-21-23-43-83/h21-23,42-43,70-82,84-100H,24-41,44-69,124-133H2,1-20H3,(H,134,162)(H,135,173)(H,136,174)(H,137,175)(H,138,176)(H,139,172)(H,140,156)(H,141,157)(H,142,158)(H,143,159)(H,144,163)(H,145,164)(H,146,165)(H,147,166)(H,148,177)(H,149,160)(H,150,167)(H,151,168)(H,152,169)(H,153,170)(H,154,171)(H,155,161)(H,178,179)/t77-,78-,79-,80-,81-,82-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-/m0/s1

InChIKey

CDJYNRHYRWNGCL-ZLONUZLYSA-N

Compound name

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

Related CIDs

• CID 16131653