CHEBI:100539 - LSM-11913

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-11913
ChEBI ID CHEBI:100539
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C28H36N4O4
Net Charge 0
Average Mass 492.611
Monoisotopic Mass 492.27366
InChI InChI=1S/C28H36N4O4/c1-30-25-22(23(19-33)26(30)27(34)29-12-5-13-31-14-16-36-17-15-31)18-32-24(25)11-10-21(28(32)35)9-8-20-6-3-2-4-7-20/h2-4,6-11,22-23,25-26,33H,5,12-19H2,1H3,(H,29,34)/t22-,23-,25+,26-/m0/s1
InChIKey LTCABXOBQOXXRS-LJCOXQHRSA-N
SMILES CN1[C@@H]2[C@@H](CN3C2=CC=C(C3=O)C=CC4=CC=CC=C4)[C@@H]([C@H]1C(=O)NCCCN5CCOCC5)CO
ChEBI Ontology
Outgoing LSM-11913 (CHEBI:100539) is a amino acid amide (CHEBI:22475)
Manual Xref Database
LSM-11913 LINCS
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