CHEBI:117284 - 2-[(1R,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide

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ChEBI Name 2-[(1R,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide
ChEBI ID CHEBI:117284
Stars This entity has been manually annotated by a third party.
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Formula C26H33N3O6
Net Charge 0
Average Mass 483.558
Monoisotopic Mass 483.23694
InChI InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m0/s1
InChIKey UPMRBEOCYVNRMT-RLCNXLTRSA-N
SMILES CN(C)CC(=O)NC1=CC2=C(C=C1)O[C@H]3[C@@H]2C[C@H](O[C@@H]3CO)CC(=O)NCC4=CC=C(C=C4)OC
ChEBI Ontology
Outgoing 2-[(1R,3S,4aR,9aS)-6-[[2-(dimethylamino)-1-oxoethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide (CHEBI:117284) is a amino acid amide (CHEBI:22475)
Manual Xref Database
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