2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenylphenyl)methyl]acetamide (CHEBI:117447)

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CHEBI:117447 - 2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenylphenyl)methyl]acetamide

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ChEBI ID	CHEBI:117447
ChEBI Name	2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenylphenyl)methyl]acetamide
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Downloads	Molfile

Formula	C30H32N2O6
Net Charge	0
Average Mass	516.594
Monoisotopic Mass	516.22604
SMILES	COCC(=O)Nc1ccc2c(c1)[C@H]1C[C@@H](CC(=O)NCc3ccc(-c4ccccc4)cc3)O[C@H](CO)[C@H]1O2
InChI	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27+,30-/m0/s1
InChIKey	GRQDGDFBWRYOPG-MFYQUPDPSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenylphenyl)methyl]acetamide (CHEBI:117447) is a biphenyls (CHEBI:22888)

Manual Xrefs	Databases
LSM-28896	LINCS