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CHEBI:45131 - N-[DIHYDROXY(PROPYL)-LAMBDA~4~-SULFANYL]THREONYL-N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}METHIONINAMIDE

Default Structure
ChEBI IDCHEBI:45131
ChEBI NameN-[DIHYDROXY(PROPYL)-LAMBDA~4~-SULFANYL]THREONYL-N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}METHIONINAMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC20H33N5O5S2
Net Charge0
Average Mass487.648
Monoisotopic Mass487.19231
SMILES[H]/N=C(/c1c([H])c([H])c(C([H])([H])N([H])C(=O)[C@@]([H])(N([H])C(=O)[C@]([H])(N([H])S(=O)(=O)C([H])([H])C([H])([H])C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])[H])C([H])([H])C([H])([H])SC([H])([H])[H])c([H])c1[H])N([H])[H]
InChIInChI=1S/C20H33N5O5S2/c1-4-11-32(29,30)25-17(13(2)26)20(28)24-16(9-10-31-3)19(27)23-12-14-5-7-15(8-6-14)18(21)22/h5-8,13,16-17,25-26H,4,9-12H2,1-3H3,(H3,21,22)(H,23,27)(H,24,28)/t13-,16-,17+/m0/s1
InChIKeyAIIJKVORRBMJHS-RRQGHBQHSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[DIHYDROXY(PROPYL)-LAMBDA~4~-SULFANYL]THREONYL-N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}METHIONINAMIDE (CHEBI:45131) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N-[DIHYDROXY(PROPYL)-LAMBDA~4~-SULFANYL]THREONYL-N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}METHIONINAMIDEPDBeChem
N-(propylsulfonyl)-D-threonyl-N-(4-carbamimidoylbenzyl)-L-methioninamidePDBeChem
Manual XrefsDatabases
PSMPDBeChem