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CHEBI:9524 - Thermospine

ChEBI IDCHEBI:9524
ChEBI NameThermospine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20N2O
Net Charge0
Average Mass244.338
Monoisotopic Mass244.15756
SMILES[H][C@@]12CCCCN1C[C@H]1C[C@@H]2Cn2c1cccc2=O
InChIInChI=1S/C15H20N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h3,5-6,11-13H,1-2,4,7-10H2/t11?,12?,13-/m0/s1
InChIKeyFQEQMASDZFXSJI-BPCQOVAHSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Thermospine (CHEBI:9524) is a alkaloid (CHEBI:22315)
Synonyms  Source
(-)-ThermopsineKEGG COMPOUND
ThermospineKEGG COMPOUND
Manual XrefsDatabases
C00002238KNApSAcK
C10789KEGG COMPOUND
Registry NumbersSources
CAS:486-90-8KEGG COMPOUND