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CHEBI:99160 - LSM-10539

Default Structure
ChEBI IDCHEBI:99160
ChEBI NameLSM-10539
Stars
DownloadsMolfile
FormulaC25H36N4O4
Net Charge0
Average Mass456.587
Monoisotopic Mass456.27366
SMILESO=C(NCCCN1CCOCC1)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1N2
InChIInChI=1S/C25H36N4O4/c30-16-19-20-15-29-21(8-7-18(25(29)32)17-5-2-1-3-6-17)23(27-20)22(19)24(31)26-9-4-10-28-11-13-33-14-12-28/h5,7-8,19-20,22-23,27,30H,1-4,6,9-16H2,(H,26,31)/t19-,20-,22+,23+/m1/s1
InChIKeyQXIHUUSMHZUCPE-SCPDWHHUSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-10539 (CHEBI:99160) has functional parent β-amino acid (CHEBI:33706)
LSM-10539 (CHEBI:99160) is a organonitrogen compound (CHEBI:35352)
LSM-10539 (CHEBI:99160) is a organooxygen compound (CHEBI:36963)
Manual XrefsDatabases
LSM-10539LINCS