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CHEBI:98597 - LSM-9976

ChEBI IDCHEBI:98597
ChEBI NameLSM-9976
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FormulaC30H35FN2O3
Net Charge0
Average Mass490.619
Monoisotopic Mass490.26317
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2ccccc2-c2ccccc2CO[C@@H]1CN(C)Cc1cccc(F)c1
InChIInChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1
InChIKeyZIZYGTWNPVBARE-IEOSBIPESA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
LSM-9976 (CHEBI:98597) is a aromatic amine (CHEBI:33860)
Manual XrefsDatabases
LSM-9976LINCS