CHEBI:129445 - 3-cyclohexyl-1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-9-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methylurea

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-cyclohexyl-1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-9-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methylurea
ChEBI ID CHEBI:129445
Stars This entity has been manually annotated by a third party.
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Formula C28H45N5O5
Net Charge 0
Average Mass 531.688
Monoisotopic Mass 531.34207
InChI InChI=1S/C28H45N5O5/c1-18(2)29-27(36)30-23-11-12-24-21(13-23)14-26(35)33(20(4)17-34)15-19(3)25(38-24)16-32(5)28(37)31-22-9-7-6-8-10-22/h11-13,18-20,22,25,34H,6-10,14-17H2,1-5H3,(H,31,37)(H2,29,30,36)/t19-,20-,25-/m0/s1
InChIKey RCXZWUYRMIXVKB-RLSLOFABSA-N
SMILES C[C@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)NC(C)C)O[C@H]1CN(C)C(=O)NC3CCCCC3)[C@@H](C)CO
ChEBI Ontology
Outgoing 3-cyclohexyl-1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-9-[[oxo-(propan-2-ylamino)methyl]amino]-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methylurea (CHEBI:129445) is a aromatic ether (CHEBI:35618)
Manual Xref Database
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