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CHEBI:221718 - Mycosporine-lysine

ChEBI IDCHEBI:221718
ChEBI NameMycosporine-lysine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H24N2O6
Net Charge0
Average Mass316.354
Monoisotopic Mass316.16344
SMILESCOC1=C(NCCCCC(N)C(=O)O)CC(O)(CO)CC1=O
InChIInChI=1S/C14H24N2O6/c1-22-12-10(6-14(21,8-17)7-11(12)18)16-5-3-2-4-9(15)13(19)20/h9,16-17,21H,2-8,15H2,1H3,(H,19,20)
InChIKeyLFXJZRGVICKOLP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nodulariaspeciesmigena (ncbitaxon:70799) - PubMed (19691450)
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)
Mycosporine-lysine (CHEBI:221718) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-amino-6-[[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-oxocyclohexen-1-yl]amino]hexanoic acid