CHEBI:102290 - 2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide

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ChEBI Name 2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide
ChEBI ID CHEBI:102290
Stars This entity has been manually annotated by a third party.
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Formula C23H27N3O6
Net Charge 0
Average Mass 441.478
Monoisotopic Mass 441.18999
InChI InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1
InChIKey HQZJCXNXJWTAKA-VSCJKUSUSA-N
SMILES COCC(=O)NC1=CC2=C(C=C1)O[C@@H]3[C@H]2C[C@H](O[C@@H]3CO)CC(=O)NCC4=CN=CC=C4
ChEBI Ontology
Outgoing 2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(3-pyridinylmethyl)acetamide (CHEBI:102290) is a furopyran (CHEBI:74927)
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