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CHEBI:98573 - LSM-9952

Default Structure
ChEBI IDCHEBI:98573
ChEBI NameLSM-9952
Stars
DownloadsMolfile
FormulaC28H39N3O4
Net Charge0
Average Mass481.637
Monoisotopic Mass481.29406
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2ccccc2-c2ccccc2CO[C@H]1CN(C)C(=O)CCN(C)C
InChIInChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26+/m1/s1
InChIKeyIEBNCDQMHLDDBS-SWYRRKHMSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-9952 (CHEBI:98573) has functional parent β-amino acid (CHEBI:33706)
LSM-9952 (CHEBI:98573) is a organonitrogen compound (CHEBI:35352)
LSM-9952 (CHEBI:98573) is a organooxygen compound (CHEBI:36963)
Manual XrefsDatabases
LSM-9952LINCS