N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide (CHEBI:130229)

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CHEBI:130229 - N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide

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ChEBI ID	CHEBI:130229
ChEBI Name	N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide
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Downloads	Molfile

Formula	C29H38N2O5S
Net Charge	0
Average Mass	526.699
Monoisotopic Mass	526.25014
SMILES	C[C@@H]1CN([C@H](C)CO)S(=O)(=O)c2ccc(C3=CCCCC3)cc2O[C@H]1CN(C)C(=O)Cc1ccccc1
InChI	InChI=1S/C29H38N2O5S/c1-21-18-31(22(2)20-32)37(34,35)28-15-14-25(24-12-8-5-9-13-24)17-26(28)36-27(21)19-30(3)29(33)16-23-10-6-4-7-11-23/h4,6-7,10-12,14-15,17,21-22,27,32H,5,8-9,13,16,18-20H2,1-3H3/t21-,22-,27+/m1/s1
InChIKey	YNRAMKWVNRHNLY-LOYIFYEOSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-phenylacetamide (CHEBI:130229) is a acetamides (CHEBI:22160)

Manual Xrefs	Databases
LSM-41778	LINCS