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CHEBI:110417 - 2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide

ChEBI IDCHEBI:110417
ChEBI Name2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
Stars
DownloadsMolfile
FormulaC24H30N2O7S
Net Charge0
Average Mass490.578
Monoisotopic Mass490.17737
SMILESCCCNC(=O)C[C@@H]1C[C@H]2c3cc(NS(=O)(=O)c4cccc(OC)c4)ccc3O[C@H]2[C@H](CO)O1
InChIInChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22-,24+/m0/s1
InChIKeyYUJPPMQDMPRDFH-LGCHTUQSSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide (CHEBI:110417) is a sulfonamide (CHEBI:35358)
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