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CHEBI:125857 - 1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea

ChEBI IDCHEBI:125857
ChEBI Name1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea
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DownloadsMolfile
FormulaC33H38N4O8
Net Charge0
Average Mass618.687
Monoisotopic Mass618.26896
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3c(c2)OCO3)Oc2ccc(NC(=O)Nc3ccc4c(c3)OCO4)cc2CC1=O
InChIInChI=1S/C33H38N4O8/c1-20-14-37(21(2)17-38)32(39)12-23-11-24(34-33(40)35-25-6-9-28-30(13-25)44-19-42-28)5-8-26(23)45-31(20)16-36(3)15-22-4-7-27-29(10-22)43-18-41-27/h4-11,13,20-21,31,38H,12,14-19H2,1-3H3,(H2,34,35,40)/t20-,21+,31+/m0/s1
InChIKeyQMJDGTKOTWCVIL-XYTRMVCOSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea (CHEBI:125857) is a benzodioxoles (CHEBI:38298)
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