EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:127423 - 2-[(3R,6aR,8S,10aR)-1-benzoyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide

ChEBI IDCHEBI:127423
ChEBI Name2-[(3R,6aR,8S,10aR)-1-benzoyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
Stars
DownloadsMolfile
FormulaC30H32N2O5
Net Charge0
Average Mass500.595
Monoisotopic Mass500.23112
SMILESO=C(C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccccc2)O1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C30H32N2O5/c33-25-18-32(30(35)23-9-5-2-6-10-23)27-16-15-26(37-28(27)20-36-19-25)17-29(34)31-24-13-11-22(12-14-24)21-7-3-1-4-8-21/h1-14,25-28,33H,15-20H2,(H,31,34)/t25-,26+,27-,28+/m1/s1
InChIKeyKXQIJHZIPZZZSG-GCFVYEKYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aR,8S,10aR)-1-benzoyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide (CHEBI:127423) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-38981LINCS