CHEBI:100441 - LSM-11816

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-11816
ChEBI ID CHEBI:100441
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H32N2O4
Net Charge 0
Average Mass 424.534
Monoisotopic Mass 424.23621
InChI InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24-/m0/s1
InChIKey PBZGESVUNIXUSB-RHGYRFJNSA-N
SMILES C[C@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@H]1CN(C)C(=O)C)[C@H](C)CO
ChEBI Ontology
Outgoing LSM-11816 (CHEBI:100441) is a benzenoid aromatic compound (CHEBI:33836)
Manual Xref Database
LSM-11816 LINCS
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