EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:108665 - 1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea

ChEBI IDCHEBI:108665
ChEBI Name1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea
Stars
DownloadsMolfile
FormulaC23H36N4O4
Net Charge0
Average Mass432.565
Monoisotopic Mass432.27366
SMILESCNC[C@@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N([C@H](C)CO)C[C@@H]1C
InChIInChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20-/m0/s1
InChIKeyHFFGMDRCIAVIES-YRNRMSPPSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclohexyl-3-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]urea (CHEBI:108665) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
LSM-20064LINCS