CHEBI:118049 - N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[[1-oxo-2-(3-pyridinyl)ethyl]amino]-2-oxanyl]acetamide

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[[1-oxo-2-(3-pyridinyl)ethyl]amino]-2-oxanyl]acetamide ChEBI ID CHEBI:118049 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 C23H27N3O6 Net Charge 0 Average Mass 441.478 Monoisotopic Mass 441.18999 InChI InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21+/m1/s1 InChIKey SPUVHZZOUOXYGN-OPYAIIAOSA-N SMILES C1C[C@H]([C@@H](O[C@H]1CC(=O)NCC2=CC3=C(C=C2)OCO3)CO)NC(=O)CC4=CN=CC=C4 ChEBI Ontology Outgoing N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[[1-oxo-2-(3-pyridinyl)ethyl]amino]-2-oxanyl]acetamide (CHEBI:118049) is a C-glycosyl compound (CHEBI:20857) Manual Xref Database LSM-29498 LINCS View more database links