CHEBI:125977 - N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide

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ChEBI Name N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide
ChEBI ID CHEBI:125977
Stars This entity has been manually annotated by a third party.
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Formula C32H39N3O5
Net Charge 0
Average Mass 545.670
Monoisotopic Mass 545.28897
InChI InChI=1S/C32H39N3O5/c1-22-18-35(23(2)21-36)32(38)28-17-26(33-31(37)16-24-8-6-5-7-9-24)12-15-29(28)40-30(22)20-34(3)19-25-10-13-27(39-4)14-11-25/h5-15,17,22-23,30,36H,16,18-21H2,1-4H3,(H,33,37)/t22-,23-,30-/m0/s1
InChIKey RZTDCHBKGWJHSA-ZRLASMASSA-N
SMILES C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)O[C@H]1CN(C)CC4=CC=C(C=C4)OC)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)methyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide (CHEBI:125977) is a acetamides (CHEBI:22160)
Manual Xref Database
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