N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide (CHEBI:124392)

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CHEBI:124392 - N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide

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ChEBI ID	CHEBI:124392
ChEBI Name	N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide
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Downloads	Molfile

Formula	C32H36F3N3O4
Net Charge	0
Average Mass	583.651
Monoisotopic Mass	583.26579
SMILES	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C(F)(F)F)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O
InChI	InChI=1S/C32H36F3N3O4/c1-21-17-38(22(2)20-39)31(41)27-16-26(36-30(40)15-23-7-5-4-6-8-23)13-14-28(27)42-29(21)19-37(3)18-24-9-11-25(12-10-24)32(33,34)35/h4-14,16,21-22,29,39H,15,17-20H2,1-3H3,(H,36,40)/t21-,22+,29-/m0/s1
InChIKey	FBQLWMVPJOKXNU-KERYWQKISA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-phenylacetamide (CHEBI:124392) is a (trifluoromethyl)benzenes (CHEBI:83565)

Manual Xrefs	Databases
LSM-35834	LINCS