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CHEBI:110219 - N-[(1S,3S,4aS,9aR)-3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide

ChEBI IDCHEBI:110219
ChEBI NameN-[(1S,3S,4aS,9aR)-3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
Stars
DownloadsMolfile
FormulaC26H29FN2O5
Net Charge0
Average Mass468.525
Monoisotopic Mass468.20605
SMILESO=C(C[C@@H]1C[C@H]2c3cc(NC(=O)CC4CC4)ccc3O[C@H]2[C@H](CO)O1)NCc1ccccc1F
InChIInChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23-,26+/m0/s1
InChIKeyRQLOITHXBXVBKT-AHNRGXKQSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(1S,3S,4aS,9aR)-3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide (CHEBI:110219) is a furopyran (CHEBI:74927)
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