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CHEBI:46326 - N-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide

ChEBI IDCHEBI:46326
ChEBI NameN-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide
Stars
ASCII NameN-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide
Last Modified19 December 2014
DownloadsMolfile
FormulaC31H37N3O5S
Net Charge0
Average Mass563.720
Monoisotopic Mass563.24539
SMILES[H]c1c([H])c([H])c(C([H])([H])C([H])([H])[C@]([H])(N([H])C(=O)[C@@]([H])(N([H])C(=O)N2C([H])([H])C([H])([H])OC([H])([H])C2([H])[H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])C([H])([H])S(=O)(=O)c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H]
InChIInChI=1S/C31H37N3O5S/c35-30(29(24-26-12-6-2-7-13-26)33-31(36)34-19-21-39-22-20-34)32-27(17-16-25-10-4-1-5-11-25)18-23-40(37,38)28-14-8-3-9-15-28/h1-15,27,29H,16-24H2,(H,32,35)(H,33,36)/t27-,29-/m0/s1
InChIKeyNNOXYPYTWAQTTO-YTMVLYRLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide (CHEBI:46326) is a L-phenylalanine derivative (CHEBI:84144)
N-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide (CHEBI:46326) is a morpholines (CHEBI:38785)
N-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamide (CHEBI:46326) is a ureas (CHEBI:47857)
Synonyms  Source
3-[[N-[MORPHOLIN-N-YL]-CARBONYL]-PHENYLALANINYL-AMINO]-5- PHENYL-PENTANE-1-SULFONYLBENZENEPDBeChem
Nalpha-(morpholin-4-ylcarbonyl)-N-{(1S)-3-phenyl-1-[2-(phenylsulfonyl)ethyl]propyl}-L-phenylalaninamidePDBeChem
Manual XrefsDatabases
VS1PDBeChem