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CHEBI:131072 - (2S,3S)-8-(1-cyclohexenyl)-2-[[cyclopentylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:131072
ChEBI Name(2S,3S)-8-(1-cyclohexenyl)-2-[[cyclopentylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC27H41N3O3
Net Charge0
Average Mass455.643
Monoisotopic Mass455.31479
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cc(C3=CCCCC3)cnc2O[C@@H]1CN(C)CC1CCCC1
InChIInChI=1S/C27H41N3O3/c1-19-15-30(20(2)18-31)27(32)24-13-23(22-11-5-4-6-12-22)14-28-26(24)33-25(19)17-29(3)16-21-9-7-8-10-21/h11,13-14,19-21,25,31H,4-10,12,15-18H2,1-3H3/t19-,20-,25+/m0/s1
InChIKeyKFKPEQDLMUYLFP-ZYLNGJIFSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-8-(1-cyclohexenyl)-2-[[cyclopentylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:131072) is a aromatic ether (CHEBI:35618)
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