2-[(2R,4aS,12aS)-8-[(2-methoxy-1-oxoethyl)amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(4-fluorophenyl)acetamide (CHEBI:97168)

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CHEBI:97168 - 2-[(2R,4aS,12aS)-8-[(2-methoxy-1-oxoethyl)amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(4-fluorophenyl)acetamide

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ChEBI ID	CHEBI:97168
ChEBI Name	2-[(2R,4aS,12aS)-8-[(2-methoxy-1-oxoethyl)amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(4-fluorophenyl)acetamide
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Downloads	Molfile

Formula	C25H28FN3O6
Net Charge	0
Average Mass	485.512
Monoisotopic Mass	485.19621
SMILES	COCC(=O)Nc1ccc2c(c1)C(=O)N(C)[C@H]1CC[C@H](CC(=O)Nc3ccc(F)cc3)O[C@@H]1CO2
InChI	InChI=1S/C25H28FN3O6/c1-29-20-9-8-18(12-23(30)27-16-5-3-15(26)4-6-16)35-22(20)13-34-21-10-7-17(11-19(21)25(29)32)28-24(31)14-33-2/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,27,30)(H,28,31)/t18-,20+,22-/m1/s1
InChIKey	SISNYLBWEAESFQ-KAGYGMCKSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[(2R,4aS,12aS)-8-[(2-methoxy-1-oxoethyl)amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(4-fluorophenyl)acetamide (CHEBI:97168) is a anilide (CHEBI:13248)

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LSM-8547	LINCS