CHEBI:102845 - N-[(2R,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

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ChEBI Name N-[(2R,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
ChEBI ID CHEBI:102845
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H29ClN2O5
Net Charge 0
Average Mass 424.919
Monoisotopic Mass 424.17650
InChI InChI=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+/m1/s1
InChIKey FKDHCSBIQDWEMT-NEWSRXKRSA-N
SMILES C1C[C@@H]([C@@H](O[C@H]1CC(=O)NCC2=CC=CC=C2Cl)CO)NC(=O)C3CCOCC3
ChEBI Ontology
Outgoing N-[(2R,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide (CHEBI:102845) is a C-glycosyl compound (CHEBI:20857)
Manual Xref Database
LSM-14191 LINCS
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