CHEBI:129083 - N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide

ChEBI IDCHEBI:129083
ChEBI NameN-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide
Stars
DownloadsMolfile
FormulaC30H43N5O5
Net Charge0
Average Mass553.704
Monoisotopic Mass553.32642
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O
InChIInChI=1S/C30H43N5O5/c1-22-18-35(23(2)21-36)30(38)17-25-16-26(32-29(37)8-11-34-12-14-39-15-13-34)4-5-27(25)40-28(22)20-33(3)19-24-6-9-31-10-7-24/h4-7,9-10,16,22-23,28,36H,8,11-15,17-21H2,1-3H3,(H,32,37)/t22-,23+,28-/m0/s1
InChIKeyZUUUVKJMPUIRPC-JWZKTCGFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide (CHEBI:129083) has functional parent β-amino acid (CHEBI:33706)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide (CHEBI:129083) is a organonitrogen compound (CHEBI:35352)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide (CHEBI:129083) is a organooxygen compound (CHEBI:36963)
Manual XrefsDatabases
LSM-40635LINCS