N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide (CHEBI:114008)

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CHEBI:114008 - N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide

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ChEBI ID	CHEBI:114008
ChEBI Name	N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide
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Formula	C27H40N4O4
Net Charge	0
Average Mass	484.641
Monoisotopic Mass	484.30496
SMILES	C[C@H]1CN([C@@H](C)CO)C(=O)c2cc(C#CCC3CCCC3)cnc2O[C@@H]1CN(C)C(=O)CN(C)C
InChI	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24+/m0/s1
InChIKey	IGZSDNHYZBOXGY-MZLICYQSSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide (CHEBI:114008) has functional parent α-amino acid (CHEBI:33704)
	N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide (CHEBI:114008) is a organonitrogen compound (CHEBI:35352)
	N-[[(2S,3S)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-(dimethylamino)-N-methylacetamide (CHEBI:114008) is a organooxygen compound (CHEBI:36963)

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LSM-25440	LINCS