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firefly D-luciferin

Properties

Image

Occurences in reactions

MNX_ID

MNXM3700

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₁₁H₇N₂O₃S₂

charge

-1

mass

278.99036

reference

chebi:58038

InChIKey

BJGNCJDXODQBOB-SSDOTTSWSA-M

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)/p-1/t7-/m1/s1

SMILES

O=C([O-])[C@H]1CSC(c2nc3ccc(O)cc3s2)=N1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58038 chebi:58038	firefly D-luciferin (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate Photinus luciferin anion Photinus luciferin carboxylate Photinus luciferin(1-)
metacyc.compound:PHOTINUS-LUCIFERIN metacycM:PHOTINUS-LUCIFERIN	D-firefly luciferin (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate (S)-2-(6'-hydroxy-2'-benzothiazolyl)-2-thiazoline-4-carboxylate D-2-(4-hydroxybenzothiazol-2-yl)-2-thiazoline acid D-photinus luciferin
seed.compound:cpd01776 seedM:cpd01776	Photinus luciferin (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate (S)-2-(6'-hydroxy-2'-benzothiazolyl)-2-thiazoline-4-carboxylate (S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4- carboxylic acid (S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid (S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid D-2-(4-hydroxybenzothiazol-2-yl)-2-thiazoline acid D-firefly luciferin D-photinus luciferin Firefly luciferin photinus luciferin
CHEBI:17165 chebi:17165	Photinus luciferin (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid (S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid (S)-4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid (S)-4,5-dihydro-2-(6-hydroxybenzothiazol-2-yl)thiazole-4-carboxylic acid Firefly luciferin firefly luciferin
kegg.compound:C02740 keggC:C02740	Photinus luciferin (S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid (S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid D-Firefly luciferin Firefly luciferin
chebi:12731 chebi:22004 chebi:8172 keggC:M_C02740 seedM:M_cpd01776	secondary/obsolete/fantasy identifier