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CHEBI:110258 - 2-[(1S,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide

ChEBI IDCHEBI:110258
ChEBI Name2-[(1S,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
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DownloadsMolfile
FormulaC20H29N3O5
Net Charge0
Average Mass391.468
Monoisotopic Mass391.21072
SMILESCN(C)CC(=O)Nc1ccc2c(c1)[C@H]1C[C@@H](CC(=O)N(C)C)O[C@@H](CO)[C@H]1O2
InChIInChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17-,20-/m0/s1
InChIKeyQAHMIWPLJULOCY-IDVHHABFSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1S,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide (CHEBI:110258) is a amino acid amide (CHEBI:22475)
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