CHEBI:106154 - N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide
ChEBI ID CHEBI:106154
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C26H37N3O5
Net Charge 0
Average Mass 471.590
Monoisotopic Mass 471.27332
InChI InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23+/m0/s1
InChIKey LMEKMJWGWXFVOU-YCRNBWNJSA-N
SMILES C[C@H]1CN(C(=O)C2=C(N=CC(=C2)C#CCOC)O[C@@H]1CN(C)C(=O)C3CCCCC3)[C@H](C)CO
ChEBI Ontology
Outgoing N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-8-(3-methoxyprop-1-ynyl)-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide (CHEBI:106154) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-17515 LINCS
View more database links