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CHEBI:44039 - 1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine

ChEBI IDCHEBI:44039
ChEBI Name1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine
Stars
ASCII Name1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine
Last Modified19 December 2014
DownloadsMolfile
FormulaC27H31N5O4S
Net Charge0
Average Mass521.643
Monoisotopic Mass521.20968
SMILES[H]/N=C(\c1c([H])c([H])c(C([H])([H])[C@]([H])(C(=O)N2C([H])([H])C([H])([H])C([H])([H])C([H])([H])C2([H])[H])N([H])C(=O)C([H])([H])N([H])S(=O)(=O)c2c([H])c([H])c3c([H])c([H])c([H])c([H])c3c2[H])c([H])c1[H])N([H])[H]
InChIInChI=1S/C27H31N5O4S/c28-26(29)21-10-8-19(9-11-21)16-24(27(34)32-14-4-1-5-15-32)31-25(33)18-30-37(35,36)23-13-12-20-6-2-3-7-22(20)17-23/h2-3,6-13,17,24,30H,1,4-5,14-16,18H2,(H3,28,29)(H,31,33)/t24-/m1/s1
InChIKeyXXTWZTPVNIYSJZ-XMMPIXPASA-N
ChEBI Ontology
Outgoing Relation(s)
1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine (CHEBI:44039) is a N-acylpiperidine (CHEBI:48591)
1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine (CHEBI:44039) is a D-phenylalanine derivative (CHEBI:84143)
1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine (CHEBI:44039) is a carboxamidine (CHEBI:35359)
1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidine (CHEBI:44039) is a naphthalenes (CHEBI:25477)
Synonyms  Source
N==ALPHA==(2-NAPHTHYL-SULFONYL-GLYCYL)-PARA-AMIDINOPHENYL-ALANYL-PIPERIDINEPDBeChem
1-[N-(naphthalen-2-ylsulfonyl)glycyl-4-carbamimidoyl-D-phenylalanyl]piperidinePDBeChem
Manual XrefsDatabases
MIDPDBeChem