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CHEBI:101828 - N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]cyclobutanecarboxamide

ChEBI IDCHEBI:101828
ChEBI NameN-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]cyclobutanecarboxamide
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DownloadsMolfile
FormulaC21H28N2O5
Net Charge0
Average Mass388.464
Monoisotopic Mass388.19982
SMILESCOc1cccc(CNC(=O)C[C@@H]2C=C[C@@H](NC(=O)C3CCC3)[C@H](CO)O2)c1
InChIInChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19-/m0/s1
InChIKeyQDYPPDFKKOAHDR-OTWHNJEPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]cyclobutanecarboxamide (CHEBI:101828) is a methoxybenzenes (CHEBI:51683)
Manual XrefsDatabases
LSM-13190LINCS