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CHEBI:124132 - N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide

ChEBI IDCHEBI:124132
ChEBI NameN-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
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DownloadsMolfile
FormulaC26H35N5O5
Net Charge0
Average Mass497.596
Monoisotopic Mass497.26382
SMILESCC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N([C@@H](C)CO)C[C@@H]1C
InChIInChI=1S/C26H35N5O5/c1-16(2)28-26(35)30(5)14-23-17(3)13-31(18(4)15-32)25(34)21-12-20(6-7-22(21)36-23)29-24(33)19-8-10-27-11-9-19/h6-12,16-18,23,32H,13-15H2,1-5H3,(H,28,35)(H,29,33)/t17-,18-,23-/m0/s1
InChIKeyKQKNLAIOLKLINJ-BSRJHKFKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide (CHEBI:124132) is a pyridinecarboxamide (CHEBI:25529)
Manual XrefsDatabases
LSM-35574LINCS