N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide (CHEBI:123630)

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CHEBI:123630 - N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide

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ChEBI ID	CHEBI:123630
ChEBI Name	N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide
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Formula	C30H48N4O5
Net Charge	0
Average Mass	544.737
Monoisotopic Mass	544.36247
SMILES	C[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)CCN3CCOCC3)ccc2O[C@H]1CN(C)CC1CCCCC1
InChI	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23+,28+/m1/s1
InChIKey	ICTRKSOOJQUIHO-IWHLBADBSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide (CHEBI:123630) has functional parent β-amino acid (CHEBI:33706)
	N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide (CHEBI:123630) is a organonitrogen compound (CHEBI:35352)
	N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide (CHEBI:123630) is a organooxygen compound (CHEBI:36963)

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