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CHEBI:63101 - N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide

ChEBI IDCHEBI:63101
ChEBI NameN2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide
Stars
ASCII NameN(2)-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N(6)-(5-nitro-2-furoyl)lysinamide
DefinitionA furan having a nitro group at position 5 and a carboxamido group in turn bearing a long-chain polyether-based multifunctional N-alkyl group at position 2.
Last Modified5 March 2014
SubmitterSteve
DownloadsMolfile
FormulaC43H62N8O13
Net Charge0
Average Mass899.012
Monoisotopic Mass898.44363
SMILESNC(=O)C(CCCCNC(=O)c1ccc([N+](=O)[O-])o1)NC(=O)CCOCCOCCNC(=O)C1CCN(C(=O)CCOCCOCCNC(=O)CCCc2cnc3ccccc23)CC1
InChIInChI=1S/C43H62N8O13/c44-41(55)35(9-3-4-17-46-43(57)36-11-12-40(64-36)51(58)59)49-38(53)15-22-60-26-28-63-25-19-47-42(56)31-13-20-50(21-14-31)39(54)16-23-61-27-29-62-24-18-45-37(52)10-5-6-32-30-48-34-8-2-1-7-33(32)34/h1-2,7-8,11-12,30-31,35,48H,3-6,9-10,13-29H2,(H2,44,55)(H,45,52)(H,46,57)(H,47,56)(H,49,53)
InChIKeyRAPOYLAEZCJMHG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide (CHEBI:63101) is a C-nitro compound (CHEBI:35716)
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide (CHEBI:63101) is a amino acid amide (CHEBI:22475)
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide (CHEBI:63101) is a furans (CHEBI:24129)
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide (CHEBI:63101) is a indoles (CHEBI:24828)
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide (CHEBI:63101) is a polyether (CHEBI:46774)
IUPAC Name 
N2-{3-[2-(2-{[(1-{3-[2-(2-{[4-(1H-indol-3-yl)butanoyl]amino}ethoxy)ethoxy]propanoyl}piperidin-4-yl)carbonyl]amino}ethoxy)ethoxy]propanoyl}-N6-(5-nitro-2-furoyl)lysinamide
Citations