CHEBI:110473 - 2-[(1S,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-methoxyethyl)acetamide

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ChEBI Name 2-[(1S,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-methoxyethyl)acetamide ChEBI ID CHEBI:110473 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C23H33N3O6 Net Charge 0 Average Mass 447.526 Monoisotopic Mass 447.23694 InChI InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20-,22+/m0/s1 InChIKey VPKMSVVJWJDGNW-JXYHXMIBSA-N SMILES COCCNC(=O)C[C@@H]1C[C@@H]2[C@H]([C@@H](O1)CO)OC3=C2C=C(C=C3)NC(=O)NC4CCCC4 ChEBI Ontology Outgoing 2-[(1S,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-methoxyethyl)acetamide (CHEBI:110473) is a furopyran (CHEBI:74927) Manual Xref Database LSM-21920 LINCS View more database links