CHEBI:50713 - pentahomomethionine

ChEBI IDCHEBI:50713
ChEBI Namepentahomomethionine
Stars
DefinitionA sulfur-containing amino acid consisting of 2-aminononanoic acid having a methylthio substituent at the 9-position.
Last Modified10 May 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H21NO2S
Net Charge0
Average Mass219.350
Monoisotopic Mass219.12930
SMILESCSCCCCCCCC(N)C(=O)O
InChIInChI=1S/C10H21NO2S/c1-14-8-6-4-2-3-5-7-9(11)10(12)13/h9H,2-8,11H2,1H3,(H,12,13)
InChIKeyGYYOKOIBHIWNHE-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
pentahomomethionine (CHEBI:50713) is a non-proteinogenic α-amino acid (CHEBI:83925)
pentahomomethionine (CHEBI:50713) is a sulfur-containing amino acid (CHEBI:26834)
pentahomomethionine (CHEBI:50713) is tautomer of pentahomomethionine zwitterion (CHEBI:58835)
Incoming Relation(s)
N-hydroxypentahomomethionine (CHEBI:50763) has functional parent pentahomomethionine (CHEBI:50713)
N,N-dihydroxypentahomomethionine (CHEBI:50770) has functional parent pentahomomethionine (CHEBI:50713)
pentahomomethionine S-oxide (CHEBI:91225) has functional parent pentahomomethionine (CHEBI:50713)
L-pentahomomethionine (CHEBI:137004) is a pentahomomethionine (CHEBI:50713)
pentahomomethionine zwitterion (CHEBI:58835) is tautomer of pentahomomethionine (CHEBI:50713)
IUPAC Name 
2-amino-9-(methylsulfanyl)nonanoic acid
Manual XrefsDatabases
C17229KEGG COMPOUND
C00007652KNApSAcK