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CHEBI:103303 - LSM-14647

ChEBI IDCHEBI:103303
ChEBI NameLSM-14647
Stars
DownloadsMolfile
FormulaC25H31N3O3
Net Charge0
Average Mass421.541
Monoisotopic Mass421.23654
SMILESCC=Cc1ccc2n(c1=O)C[C@H]1[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N1CCc1ccccc1
InChIInChI=1S/C25H31N3O3/c1-4-8-18-11-12-20-23-22(25(31)26(2)3)19(16-29)21(15-28(20)24(18)30)27(23)14-13-17-9-6-5-7-10-17/h4-12,19,21-23,29H,13-16H2,1-3H3/t19-,21-,22+,23+/m0/s1
InChIKeyIMLNKYQDLHUNSC-KZKAQZJJSA-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-14647 (CHEBI:103303) is a primary amine (CHEBI:32877)
Manual XrefsDatabases
LSM-14647LINCS