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CHEBI:124622 - N-[(2R,3S,6R)-6-[2-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(3-pyridinyl)acetamide

ChEBI IDCHEBI:124622
ChEBI NameN-[(2R,3S,6R)-6-[2-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(3-pyridinyl)acetamide
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DownloadsMolfile
FormulaC21H29N5O5
Net Charge0
Average Mass431.493
Monoisotopic Mass431.21687
SMILESCc1noc(C)c1NC(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@H](CO)O1
InChIInChI=1S/C21H29N5O5/c1-13-20(14(2)31-26-13)25-21(29)23-9-7-16-5-6-17(18(12-27)30-16)24-19(28)10-15-4-3-8-22-11-15/h3-4,8,11,16-18,27H,5-7,9-10,12H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18+/m1/s1
InChIKeyLEDFMEUSPBTDMF-SQNIBIBYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S,6R)-6-[2-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(3-pyridinyl)acetamide (CHEBI:124622) is a C-glycosyl compound (CHEBI:20857)
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