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CHEBI:2613 - Altanserin

ChEBI IDCHEBI:2613
ChEBI NameAltanserin
Stars
Last Modified24 February 2016
DownloadsMolfile
FormulaC22H22FN3O2S
Net Charge0
Average Mass411.502
Monoisotopic Mass411.14168
SMILESO=C(c1ccc(F)cc1)C1CCN(CCn2c(=S)nc3ccccc3c2=O)CC1
InChIInChI=1S/C22H22FN3O2S/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)
InChIKeySMYALUSCZJXWHG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Altanserin (CHEBI:2613) is a quinazolines (CHEBI:38530)
Synonym  Source
AltanserinKEGG COMPOUND
Manual XrefsDatabases
C11734KEGG COMPOUND
LSM-1987LINCS
Registry NumbersSources
CAS:76330-71-7KEGG COMPOUND