2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-(propan-2-ylcarbamoylamino)-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-chlorophenyl)acetamide (CHEBI:98149)

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CHEBI:98149 - 2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-(propan-2-ylcarbamoylamino)-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-chlorophenyl)acetamide

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ChEBI ID	CHEBI:98149
ChEBI Name	2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-(propan-2-ylcarbamoylamino)-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-chlorophenyl)acetamide
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Downloads	Molfile

Formula	C26H31ClN4O5
Net Charge	0
Average Mass	515.010
Monoisotopic Mass	514.19830
SMILES	CC(C)NC(=O)Nc1ccc2c(c1)C(=O)N(C)[C@H]1CC[C@H](CC(=O)Nc3ccccc3Cl)O[C@@H]1CO2
InChI	InChI=1S/C26H31ClN4O5/c1-15(2)28-26(34)29-16-8-11-22-18(12-16)25(33)31(3)21-10-9-17(36-23(21)14-35-22)13-24(32)30-20-7-5-4-6-19(20)27/h4-8,11-12,15,17,21,23H,9-10,13-14H2,1-3H3,(H,30,32)(H2,28,29,34)/t17-,21+,23-/m1/s1
InChIKey	FZGMKYAFXDIPHD-FRGLQRNOSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-(propan-2-ylcarbamoylamino)-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-chlorophenyl)acetamide (CHEBI:98149) is a anilide (CHEBI:13248)

Manual Xrefs	Databases
LSM-9528	LINCS