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CHEBI:95135 - LSM-6403

Default Structure
ChEBI IDCHEBI:95135
ChEBI NameLSM-6403
Stars
DownloadsMolfile
FormulaC21H29NO
Net Charge0
Average Mass311.469
Monoisotopic Mass311.22491
SMILESOC(CCN1CCCCC1)(c1ccccc1)C1C[C@H]2C=C[C@@H]1C2
InChIInChI=1S/C21H29NO/c23-21(19-7-3-1-4-8-19,11-14-22-12-5-2-6-13-22)20-16-17-9-10-18(20)15-17/h1,3-4,7-10,17-18,20,23H,2,5-6,11-16H2/t17-,18+,20?,21?/m0/s1
InChIKeyYSXKPIUOCJLQIE-GTROLIPKSA-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-6403 (CHEBI:95135) is a aralkylamine (CHEBI:18000)
Manual XrefsDatabases
LSM-6403LINCS