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CHEBI:98112 - LSM-9491

ChEBI IDCHEBI:98112
ChEBI NameLSM-9491
Stars
DownloadsMolfile
FormulaC27H32N2O5S2
Net Charge0
Average Mass528.696
Monoisotopic Mass528.17526
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2ccccc2-c2ccccc2CO[C@H]1CN(C)S(=O)(=O)c1ccsc1
InChIInChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26-/m0/s1
InChIKeyROXJHZXKWGUYER-DYLHXGEVSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-9491 (CHEBI:98112) is a benzenoid aromatic compound (CHEBI:33836)
Manual XrefsDatabases
LSM-9491LINCS