4-[[2-[[2-[[(2S)-6-azanyl-2-[[2-[[2-[[(2S)-6-azanyl-2-[[2-[[2-[(4-azanylpiperidin-4-yl)carbonylamino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]piperidine-4-carboxamide

Systemtic Name: 4-[[2-[[2-[[(2S)-6-azanyl-2-[[2-[[2-[[(2S)-6-azanyl-2-[[2-[[2-[(4-azanylpiperidin-4-yl)carbonylamino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]piperidine-4-carboxamide Openeye Name: 4-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[(4-aminopiperidine-4-carbonyl)amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]piperidine-4-carboxamide CAS Name: 4-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(4-amino-4-piperidinyl)-oxomethyl]amino]-2-methyl-1-oxopropyl]amino]-2-methyl-1-oxopropyl]amino]-1-oxohexyl]amino]-2-methyl-1-oxopropyl]amino]-2-methyl-1-oxopropyl]amino]-1-oxohexyl]amino]-2-methyl-1-oxopropyl]amino]-2-methyl-1-oxopropyl]amino]-4-piperidinecarboxamide IUPAC Name: 4-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[(4-aminopiperidine-4-carbonyl)amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]hexanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]hexanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]piperidine-4-carboxamide Traditional Name: 4-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(2S)-6-amino-2-[[2-[[2-[(4-aminoisonipecotoyl)amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]hexanoyl]amino]-2-methyl-propanoyl]amino]-2-methyl-propanoyl]amino]isonipecotamide Formula: C48H89N15O10 MolecularWeight: 1036.31476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CCCCN)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC1(CCNCC1)C(=O)N)NC(=O)C(C)(C)NC(=O)C(CCCCN)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C2(CCNCC2)N

Isomeric SMILES

CC(C)(C(=O)N[C@@H](CCCCN)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC1(CCNCC1)C(=O)N)NC(=O)C(C)(C)NC(=O)[C@H](CCCCN)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C2(CCNCC2)N

InChI

InChI=1S/C48H89N15O10/c1-41(2,34(67)55-30(18-14-16-24-50)32(65)58-44(7,8)37(70)61-46(11,12)39(72)63-48(33(51)66)21-27-54-28-22-48)59-36(69)43(5,6)57-31(64)29(17-13-15-23-49)56-35(68)42(3,4)60-38(71)45(9,10)62-40(73)47(52)19-25-53-26-20-47/h29-30,53-54H,13-28,49-50,52H2,1-12H3,(H2,51,66)(H,55,67)(H,56,68)(H,57,64)(H,58,65)(H,59,69)(H,60,71)(H,61,70)(H,62,73)(H,63,72)/t29-,30-/m0/s1