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CHEBI:95630 - (2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(3-methoxyphenyl)ethynyl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:95630
ChEBI Name(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(3-methoxyphenyl)ethynyl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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FormulaC24H29N3O4
Net Charge0
Average Mass423.513
Monoisotopic Mass423.21581
SMILESCNC[C@@H]1Oc2ncc(C#Cc3cccc(OC)c3)cc2C(=O)N([C@@H](C)CO)C[C@@H]1C
InChIInChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1
InChIKeyFZSLNURVQGYNPU-HOIFWPIMSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-8-[2-(3-methoxyphenyl)ethynyl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:95630) is a methoxybenzenes (CHEBI:51683)
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