CHEBI:117300 - 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-methoxyphenyl)methyl]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-methoxyphenyl)methyl]acetamide ChEBI ID CHEBI:117300 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 C28H35N3O6 Net Charge 0 Average Mass 509.595 Monoisotopic Mass 509.25259 InChI InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25-,27+/m0/s1 InChIKey DFSRPXMSRAMRJF-YSDDDFLKSA-N SMILES COC1=CC=CC=C1CNC(=O)C[C@@H]2C[C@@H]3[C@H]([C@@H](O2)CO)OC4=C3C=C(C=C4)NC(=O)NC5CCCC5 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-methoxyphenyl)methyl]acetamide (CHEBI:117300) is a furopyran (CHEBI:74927) Manual Xref Database LSM-28749 LINCS View more database links