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CHEBI:42426 - BENZYL N-[(BENZYLOXY)CARBONYL]-D-ALANYL-N~6~-[(2S,3S,4S)-3-FORMYL-2-HYDROXY-4-METHYLHEXANOYL]-L-LYSINATE

Default Structure
ChEBI IDCHEBI:42426
ChEBI NameBENZYL N-[(BENZYLOXY)CARBONYL]-D-ALANYL-N~6~-[(2S,3S,4S)-3-FORMYL-2-HYDROXY-4-METHYLHEXANOYL]-L-LYSINATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC32H43N3O8
Net Charge0
Average Mass597.709
Monoisotopic Mass597.30502
SMILES[H]O[C@]([H])(C(=O)N([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)OC([H])([H])c1c([H])c([H])c([H])c([H])c1[H])N([H])C(=O)[C@]([H])(N([H])C(=O)OC([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])[H])[C@@]([H])(C([H])=O)[C@@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H]
InChIInChI=1S/C32H43N3O8/c1-4-22(2)26(19-36)28(37)30(39)33-18-12-11-17-27(31(40)42-20-24-13-7-5-8-14-24)35-29(38)23(3)34-32(41)43-21-25-15-9-6-10-16-25/h5-10,13-16,19,22-23,26-28,37H,4,11-12,17-18,20-21H2,1-3H3,(H,33,39)(H,34,41)(H,35,38)/t22-,23+,26-,27-,28-/m0/s1
InChIKeyODPOWFGUTQNCGV-CBBNSXQPSA-N
ChEBI Ontology
Outgoing Relation(s)
BENZYL N-[(BENZYLOXY)CARBONYL]-D-ALANYL-N~6~-[(2S,3S,4S)-3-FORMYL-2-HYDROXY-4-METHYLHEXANOYL]-L-LYSINATE (CHEBI:42426) is a unclassifieds (CHEBI:27189)
Synonyms  Source
benzyl N-[(benzyloxy)carbonyl]-D-alanyl-N~6~-[(2S,3S,4S)-3-formyl-2-hydroxy-4-methylhexanoyl]-L-lysinatePDBeChem
BENZYL N-[(BENZYLOXY)CARBONYL]-D-ALANYL-N~6~-[(2S,3S,4S)-3-FORMYL-2-HYDROXY-4-METHYLHEXANOYL]-L-LYSINATEPDBeChem
Manual XrefsDatabases
ESYPDBeChem