CHEBI:108675 - N-[(2R,3R)-5-[(2R)-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-pyridinecarboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2R,3R)-5-[(2R)-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-pyridinecarboxamide
ChEBI ID CHEBI:108675
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C36H40N4O4
Net Charge 0
Average Mass 592.729
Monoisotopic Mass 592.30496
InChI InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m1/s1
InChIKey IQSVNIDGIMJPQN-UVNCRYBCSA-N
SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)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-[(2R)-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-pyridinecarboxamide (CHEBI:108675) is a biphenyls (CHEBI:22888)
Manual Xref Database
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