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CHEBI:117427 - 2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide

ChEBI IDCHEBI:117427
ChEBI Name2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
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DownloadsMolfile
FormulaC18H26N2O4
Net Charge0
Average Mass334.416
Monoisotopic Mass334.18926
SMILESCN(C)C(=O)C[C@H]1C[C@@H]2c3cc(N(C)C)ccc3O[C@@H]2[C@@H](CO)O1
InChIInChI=1S/C18H26N2O4/c1-19(2)11-5-6-15-13(7-11)14-8-12(9-17(22)20(3)4)23-16(10-21)18(14)24-15/h5-7,12,14,16,18,21H,8-10H2,1-4H3/t12-,14-,16-,18+/m1/s1
InChIKeyNLXCGGAGMQYKJV-BQUDOFGOSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide (CHEBI:117427) is a furopyran (CHEBI:74927)
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