CHEBI:118236 - 2-[(2S,5S,6S)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-(phenylmethyl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[(2S,5S,6S)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-(phenylmethyl)acetamide
ChEBI ID CHEBI:118236
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H26FN3O4
Net Charge 0
Average Mass 415.459
Monoisotopic Mass 415.19073
InChI InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m0/s1
InChIKey SDPGYCOKVZGVFV-FFZOFVMBSA-N
SMILES C1C[C@@H]([C@H](O[C@@H]1CC(=O)NCC2=CC=CC=C2)CO)NC(=O)NC3=CC=CC=C3F
ChEBI Ontology
Outgoing 2-[(2S,5S,6S)-5-[[(2-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]-N-(phenylmethyl)acetamide (CHEBI:118236) is a C-glycosyl compound (CHEBI:20857)
Manual Xref Database
LSM-29685 LINCS
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