N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methylbenzenesulfonamide (CHEBI:127850)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:127850 - N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methylbenzenesulfonamide

Take structure to advanced search

ChEBI ID	CHEBI:127850
ChEBI Name	N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methylbenzenesulfonamide
Stars
Downloads	Molfile

Formula	C37H43N3O5S
Net Charge	0
Average Mass	641.834
Monoisotopic Mass	641.29234
SMILES	Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N([C@@H](C)CO)C[C@H](C)[C@@H](CN(C)Cc2ccc(-c4ccccc4)cc2)O3)cc1
InChI	InChI=1S/C37H43N3O5S/c1-26-10-17-34(18-11-26)46(43,44)38-33-16-19-35-32(20-33)21-37(42)40(28(3)25-41)22-27(2)36(45-35)24-39(4)23-29-12-14-31(15-13-29)30-8-6-5-7-9-30/h5-20,27-28,36,38,41H,21-25H2,1-4H3/t27-,28-,36+/m0/s1
InChIKey	YDGJQJIVZCLABT-KAUPTSPVSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methylbenzenesulfonamide (CHEBI:127850) is a biphenyls (CHEBI:22888)

Manual Xrefs	Databases
LSM-39406	LINCS