CHEBI:108718 - N-[(2S,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

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ChEBI Name N-[(2S,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide
ChEBI ID CHEBI:108718
Stars This entity has been manually annotated by a third party.
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Formula C30H41N5O5
Net Charge 0
Average Mass 551.678
Monoisotopic Mass 551.31077
InChI InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27-/m1/s1
InChIKey OBYISRQTVLJVSP-LGVUCKNBSA-N
SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)O[C@@H]1CN(C)C(=O)NC4CCCCC4)[C@H](C)CO
ChEBI Ontology
Outgoing N-[(2S,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide (CHEBI:108718) is a pyridinecarboxamide (CHEBI:25529)
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