CHEBI:118001 - N-[(2R,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

ChEBI IDCHEBI:118001
ChEBI NameN-[(2R,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
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FormulaC21H29ClN2O5
Net Charge0
Average Mass424.925
Monoisotopic Mass424.17650
SMILESO=C(C[C@@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@H](CO)O1)NCc1ccccc1Cl
InChIInChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19-/m0/s1
InChIKeyFKDHCSBIQDWEMT-UHOSZYNNSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide (CHEBI:118001) is a C-glycosyl compound (CHEBI:20857)
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LSM-29450LINCS