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CHEBI:117937 - 1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-(2-methoxyphenyl)urea

ChEBI IDCHEBI:117937
ChEBI Name1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-(2-methoxyphenyl)urea
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DownloadsMolfile
FormulaC28H35N3O5
Net Charge0
Average Mass493.604
Monoisotopic Mass493.25767
SMILESCOc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO
InChIInChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26-/m0/s1
InChIKeyXNNPHUWWMNRDCG-GVUKDKGQSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-(2-methoxyphenyl)urea (CHEBI:117937) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-29386LINCS