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CHEBI:126859 - 1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-phenylurea

ChEBI IDCHEBI:126859
ChEBI Name1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-phenylurea
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DownloadsMolfile
FormulaC23H30N4O4
Net Charge0
Average Mass426.517
Monoisotopic Mass426.22671
SMILESCNC[C@H]1Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)19-11-18(9-10-20(19)31-21(15)12-24-3)26-23(30)25-17-7-5-4-6-8-17/h4-11,15-16,21,24,28H,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,21-/m1/s1
InChIKeyXZCLZSCKQUIJEK-WHSLLNHNSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-phenylurea (CHEBI:126859) is a ureas (CHEBI:47857)
Manual XrefsDatabases
LSM-38422LINCS