CHEBI:128591 - 1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea

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ChEBI Name 1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
ChEBI ID CHEBI:128591
Stars This entity has been manually annotated by a third party.
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Formula C20H32N4O4
Net Charge 0
Average Mass 392.493
Monoisotopic Mass 392.24236
InChI InChI=1S/C20H32N4O4/c1-12(2)22-20(27)23-16-8-6-7-15-18(16)28-17(9-21-5)13(3)10-24(19(15)26)14(4)11-25/h6-8,12-14,17,21,25H,9-11H2,1-5H3,(H2,22,23,27)/t13-,14-,17-/m0/s1
InChIKey IJNNGEYJEFGHTL-ZQIUZPCESA-N
SMILES C[C@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)NC(C)C)O[C@H]1CNC)[C@@H](C)CO
ChEBI Ontology
Outgoing 1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea (CHEBI:128591) is a aromatic ether (CHEBI:35618)
Manual Xref Database
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