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CHEBI:100898 - LSM-12272

ChEBI IDCHEBI:100898
ChEBI NameLSM-12272
Stars
DownloadsMolfile
FormulaC31H35N3O6
Net Charge0
Average Mass545.636
Monoisotopic Mass545.25259
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3c(c2)OCO3)OCc2ccccc2-c2ccccc2C1=O
InChIInChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29+/m0/s1
InChIKeyAPWUXYFXBMGRIO-BNJCFXFUSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-12272 (CHEBI:100898) is a benzodioxoles (CHEBI:38298)
Manual XrefsDatabases
LSM-12272LINCS