CHEBI:124269 - N-[(2R,3R)-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]cyclopropanecarboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2R,3R)-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]cyclopropanecarboxamide
ChEBI ID CHEBI:124269
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C34H41N3O4
Net Charge 0
Average Mass 555.708
Monoisotopic Mass 555.30971
InChI InChI=1S/C34H41N3O4/c1-23-19-37(24(2)22-38)33(39)18-29-17-30(35-34(40)28-13-14-28)15-16-31(29)41-32(23)21-36(3)20-25-9-11-27(12-10-25)26-7-5-4-6-8-26/h4-12,15-17,23-24,28,32,38H,13-14,18-22H2,1-3H3,(H,35,40)/t23-,24+,32+/m1/s1
InChIKey VPBPSAFWKPFOOJ-FXZPAHAQSA-N
SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3CC3)O[C@H]1CN(C)CC4=CC=C(C=C4)C5=CC=CC=C5)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3R)-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]cyclopropanecarboxamide (CHEBI:124269) is a biphenyls (CHEBI:22888)
Manual Xref Database
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