CHEBI:17216 - oxidized Cypridina luciferin

ChEBI IDCHEBI:17216
ChEBI Nameoxidized Cypridina luciferin
Stars
ASCII Nameoxidized Cypridina luciferin
Secondary ChEBI IDsCHEBI:7827, CHEBI:14709, CHEBI:25742
Last Modified7 September 2007
DownloadsMolfile
FormulaC21H27N7O
Net Charge0
Average Mass393.495
Monoisotopic Mass393.22771
SMILESCC[C@H](C)C(=O)Nc1ncc(-c2cnc3ccccc23)nc1CCCNC(=N)N
InChIInChI=1S/C21H27N7O/c1-3-13(2)20(29)28-19-17(9-6-10-24-21(22)23)27-18(12-26-19)15-11-25-16-8-5-4-7-14(15)16/h4-5,7-8,11-13,25H,3,6,9-10H2,1-2H3,(H4,22,23,24)(H,26,28,29)/t13-/m0/s1
InChIKeyPSYJEEMZZIZTSR-ZDUSSCGKSA-N
Roles Classification
Chemical Roles:
luciferin  A low-molecular-mass compound present in bioluminescent organisms that emits light when oxidized in presence of enzyme luciferase.
Biological Roles:
luciferin  A low-molecular-mass compound present in bioluminescent organisms that emits light when oxidized in presence of enzyme luciferase.
ChEBI Ontology
Outgoing Relation(s)
oxidized Cypridina luciferin (CHEBI:17216) has role oxidized luciferins (CHEBI:25747)
oxidized Cypridina luciferin (CHEBI:17216) is a Cypridina luciferin (CHEBI:17073)
oxidized Cypridina luciferin (CHEBI:17216) is a guanidines (CHEBI:24436)
oxidized Cypridina luciferin (CHEBI:17216) is a pyrazines (CHEBI:38314)
oxidized Cypridina luciferin (CHEBI:17216) is conjugate base of oxidized Cypridina luciferin(1+) (CHEBI:58059)
Incoming Relation(s)
oxidized Cypridina luciferin(1+) (CHEBI:58059) is conjugate acid of oxidized Cypridina luciferin (CHEBI:17216)
IUPAC Name 
1-(3-{6-(1H-indol-3-yl)-3-[(2S)-2-methylbutanamido]pyrazin-2-yl}propyl)guanidine
Synonym  Source
Oxidized Cypridina luciferinKEGG COMPOUND
Manual XrefsDatabases
C03887KEGG COMPOUND
C03887KEGG COMPOUND