N-[(2S,3R)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-phenylacetamide (CHEBI:124904)

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CHEBI:124904 - N-[(2S,3R)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-phenylacetamide

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ChEBI ID	CHEBI:124904
ChEBI Name	N-[(2S,3R)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-phenylacetamide
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Downloads	Molfile

Formula	C33H39N3O6
Net Charge	0
Average Mass	573.690
Monoisotopic Mass	573.28389
SMILES	C[C@@H]1CN([C@H](C)CO)C(=O)Cc2cc(NC(=O)Cc3ccccc3)ccc2O[C@@H]1CN(C)Cc1ccc2c(c1)OCO2
InChI	InChI=1S/C33H39N3O6/c1-22-17-36(23(2)20-37)33(39)16-26-15-27(34-32(38)14-24-7-5-4-6-8-24)10-12-28(26)42-31(22)19-35(3)18-25-9-11-29-30(13-25)41-21-40-29/h4-13,15,22-23,31,37H,14,16-21H2,1-3H3,(H,34,38)/t22-,23-,31-/m1/s1
InChIKey	WEABPWUDUMFAMI-CEFNRUSXSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2S,3R)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-phenylacetamide (CHEBI:124904) is a acetamides (CHEBI:22160)

Manual Xrefs	Databases
LSM-36346	LINCS