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CHEBI:59564 - thermospermine

ChEBI IDCHEBI:59564
ChEBI Namethermospermine
Stars
DefinitionPropane-1,3-diamine in which a hydrogen attached to one nitrogen is substituted by a 3-aminoprop-1-yl group, and a hydrogen attached to the other nitrogen is substituted by a 4-aminobut-1-yl group. A polyamine natural product, its name arises from its similarity to spermine and the fact that it was first isolated from the extreme thermophile, Thermus thermophilus.
Last Modified1 June 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC10H26N4
Net Charge0
Average Mass202.346
Monoisotopic Mass202.21575
SMILESNCCCCNCCCNCCCN
InChIInChI=1S/C10H26N4/c11-5-1-2-7-13-9-4-10-14-8-3-6-12/h13-14H,1-12H2
InChIKeyDODDBCGMRAFLEB-UHFFFAOYSA-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)
thermospermine (CHEBI:59564) is a polyazaalkane (CHEBI:39474)
thermospermine (CHEBI:59564) is a tetramine (CHEBI:39166)
thermospermine (CHEBI:59564) is conjugate base of thermosperminium(4+) (CHEBI:59903)
Incoming Relation(s)
thermosperminium(4+) (CHEBI:59903) is conjugate acid of thermospermine (CHEBI:59564)
IUPAC Name 
N-{3-[(3-aminopropyl)amino]propyl}butane-1,4-diamine
Synonyms  Source
1,12-diamino-4,8-diazadodecaneChemIDplus
N1-(3-(3-aminopropylamino)propyl)butane-1,4-diamineChEBI
Registry NumbersSources
Beilstein:2236642Beilstein
CAS:70862-11-2ChemIDplus
Citations