1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea (CHEBI:94858)

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CHEBI:94858 - 1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea

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ChEBI ID	CHEBI:94858
ChEBI Name	1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
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Formula	C34H38N4O6S
Net Charge	0
Average Mass	630.767
Monoisotopic Mass	630.25121
SMILES	Cc1ccc(S(=O)(=O)N(C)C[C@@H]2Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C(=O)N([C@H](C)CO)C[C@H]2C)cc1
InChI	InChI=1S/C34H38N4O6S/c1-22-15-17-26(18-16-22)45(42,43)37(4)20-31-23(2)19-38(24(3)21-39)33(40)28-12-8-14-30(32(28)44-31)36-34(41)35-29-13-7-10-25-9-5-6-11-27(25)29/h5-18,23-24,31,39H,19-21H2,1-4H3,(H2,35,36,41)/t23-,24-,31+/m1/s1
InChIKey	VPRUVRPQZVHKTA-GQIGMWPISA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea (CHEBI:94858) is a sulfonamide (CHEBI:35358)

Manual Xrefs	Databases
LSM-6077	LINCS