Photinus luciferin (CHEBI:17165)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	Photinus luciferin

ChEBI ID	CHEBI:17165

ChEBI ASCII Name	Photinus luciferin

Definition	A 1,3-thiazolemonocarboxylic acid consisting of 3,5-dihydrothiophene-4-carboxylic acid having a 6-hydroxybenzothiazol-2-yl group at the 2-position.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:8172, CHEBI:12731, CHEBI:22004

Supplier Information

Download	Molfile XML SDF

more structures >>

Formula

C11H8N2O3S2

Net Charge

Average Mass

280.32490

Monoisotopic Mass

279.99763

InChI

InChI=1S/C11H8N2O3S2/c14-5-1-2-6-8(3-5)18-10(12-6)9-13-7(4-17-9)11(15)16/h1-3,7,14H,4H2,(H,15,16)/t7-/m1/s1

InChIKey

BJGNCJDXODQBOB-SSDOTTSWSA-N

SMILES

[H][C@@]1(CSC(=N1)c1nc2ccc(O)cc2s1)C(O)=O

Roles Classification
Chemical Role(s):	luciferin A low-molecular-mass compound present in bioluminescent organisms that emits light when oxidized in presence of enzyme luciferase. Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	luciferin A low-molecular-mass compound present in bioluminescent organisms that emits light when oxidized in presence of enzyme luciferase.

ChEBI Ontology
Outgoing	Photinus luciferin (CHEBI:17165) has role luciferin (CHEBI:25078) Photinus luciferin (CHEBI:17165) is a 1,3-thiazolemonocarboxylic acid (CHEBI:48652) Photinus luciferin (CHEBI:17165) is a benzothiazoles (CHEBI:37947) Photinus luciferin (CHEBI:17165) is a imidothioate (CHEBI:83991) Photinus luciferin (CHEBI:17165) is conjugate acid of Photinus luciferin(1−) (CHEBI:58038) Photinus luciferin (CHEBI:17165) is enantiomer of ent-Photinus luciferin (CHEBI:139036)

Incoming	firefly sulfoluciferin (CHEBI:133462) has functional parent Photinus luciferin (CHEBI:17165) oxidized Photinus luciferin (CHEBI:16792) is a Photinus luciferin (CHEBI:17165) Photinus luciferin(1−) (CHEBI:58038) is conjugate base of Photinus luciferin (CHEBI:17165) ent-Photinus luciferin (CHEBI:139036) is enantiomer of Photinus luciferin (CHEBI:17165)

IUPAC Name

(4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid

Synonyms	Sources
(S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid	KEGG COMPOUND
(S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid	KEGG COMPOUND
(S)-4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid	ChemIDplus
(S)-4,5-dihydro-2-(6-hydroxybenzothiazol-2-yl)thiazole-4-carboxylic acid	ChemIDplus
Firefly luciferin	KEGG COMPOUND
firefly luciferin	ChemIDplus
Photinus luciferin	KEGG COMPOUND

Last Modified

14 November 2017