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CHEBI:125756 - 2-[(2R,4aR,12aS)-5-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-propylacetamide

ChEBI IDCHEBI:125756
ChEBI Name2-[(2R,4aR,12aS)-5-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-propylacetamide
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DownloadsMolfile
FormulaC23H34N4O5
Net Charge0
Average Mass446.548
Monoisotopic Mass446.25292
SMILESCCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)NC(C)C)cc3C(=O)N2C)O1
InChIInChI=1S/C23H34N4O5/c1-5-10-24-21(28)12-16-7-8-18-20(32-16)13-31-19-9-6-15(26-23(30)25-14(2)3)11-17(19)22(29)27(18)4/h6,9,11,14,16,18,20H,5,7-8,10,12-13H2,1-4H3,(H,24,28)(H2,25,26,30)/t16-,18-,20-/m1/s1
InChIKeyCVKUXGCCCXQKFR-YVWKXTFCSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(2R,4aR,12aS)-5-methyl-6-oxo-8-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-propylacetamide (CHEBI:125756) is a aromatic ether (CHEBI:35618)
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