2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-[[oxo-[(phenylmethyl)amino]methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(3-propan-2-ylphenyl)acetamide (CHEBI:126776)

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CHEBI:126776 - 2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-[[oxo-[(phenylmethyl)amino]methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(3-propan-2-ylphenyl)acetamide

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ChEBI ID	CHEBI:126776
ChEBI Name	2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-[[oxo-[(phenylmethyl)amino]methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(3-propan-2-ylphenyl)acetamide
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Downloads	Molfile

Formula	C33H38N4O5
Net Charge	0
Average Mass	570.690
Monoisotopic Mass	570.28422
SMILES	CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)NCc5ccccc5)cc4C(=O)N3C)O2)c1
InChI	InChI=1S/C33H38N4O5/c1-21(2)23-10-7-11-24(16-23)35-31(38)18-26-13-14-28-30(42-26)20-41-29-15-12-25(17-27(29)32(39)37(28)3)36-33(40)34-19-22-8-5-4-6-9-22/h4-12,15-17,21,26,28,30H,13-14,18-20H2,1-3H3,(H,35,38)(H2,34,36,40)/t26-,28+,30-/m1/s1
InChIKey	RYEAYNKUHHLTHO-JNQIMCCTSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-[[oxo-[(phenylmethyl)amino]methyl]amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(3-propan-2-ylphenyl)acetamide (CHEBI:126776) is a anilide (CHEBI:13248)

Manual Xrefs	Databases
LSM-38339	LINCS