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CHEBI:96088 - (2R,3S)-8-(3-cyclohexylprop-1-ynyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:96088
ChEBI Name(2R,3S)-8-(3-cyclohexylprop-1-ynyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC30H40N4O3
Net Charge0
Average Mass504.675
Monoisotopic Mass504.31004
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ncc(C#CCC3CCCCC3)cc2C1=O
InChIInChI=1S/C30H40N4O3/c1-22-18-34(23(2)21-35)30(36)27-16-26(11-7-10-24-8-5-4-6-9-24)17-32-29(27)37-28(22)20-33(3)19-25-12-14-31-15-13-25/h12-17,22-24,28,35H,4-6,8-10,18-21H2,1-3H3/t22-,23+,28-/m0/s1
InChIKeyMOHYNDWRXWCXBE-JWZKTCGFSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S)-8-(3-cyclohexylprop-1-ynyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:96088) is a aromatic ether (CHEBI:35618)
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