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CHEBI:100587 - LSM-11961

Default Structure
ChEBI IDCHEBI:100587
ChEBI NameLSM-11961
Stars
DownloadsMolfile
FormulaC26H29N3O3
Net Charge0
Average Mass431.536
Monoisotopic Mass431.22089
SMILESO=C(NC1Cc2ccccc2C1)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2
InChIInChI=1S/C26H29N3O3/c30-14-20-21-13-29-22(10-9-19(26(29)32)15-5-1-2-6-15)24(28-21)23(20)25(31)27-18-11-16-7-3-4-8-17(16)12-18/h3-5,7-10,18,20-21,23-24,28,30H,1-2,6,11-14H2,(H,27,31)/t20-,21-,23+,24+/m0/s1
InChIKeyOCQMLVVPVHYQPL-NEUULRRLSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-11961 (CHEBI:100587) has functional parent β-amino acid (CHEBI:33706)
LSM-11961 (CHEBI:100587) is a organonitrogen compound (CHEBI:35352)
LSM-11961 (CHEBI:100587) is a organooxygen compound (CHEBI:36963)
Manual XrefsDatabases
LSM-11961LINCS