CHEBI:101111 - LSM-12480

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-12480
ChEBI ID CHEBI:101111
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H30N2O3
Net Charge 0
Average Mass 382.497
Monoisotopic Mass 382.22564
InChI InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17+,22+/m0/s1
InChIKey VMUIUYUBOUUZSN-GSHUGGBRSA-N
SMILES C[C@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CNC)[C@H](C)CO
ChEBI Ontology
Outgoing LSM-12480 (CHEBI:101111) is a benzenoid aromatic compound (CHEBI:33836)
Manual Xref Database
LSM-12480 LINCS
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