EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:124120 - N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide

ChEBI IDCHEBI:124120
ChEBI NameN-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
Stars
DownloadsMolfile
FormulaC23H35N3O4
Net Charge0
Average Mass417.550
Monoisotopic Mass417.26276
SMILESCNC[C@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21-/m1/s1
InChIKeyNQJCYDIBEOZMBZ-WHSLLNHNSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide (CHEBI:124120) is a aromatic amide (CHEBI:62733)
Manual XrefsDatabases
LSM-35562LINCS