Firefly luciferin

C11H8N2O3S2CAS 2591-17-5280.32 g/mol

OOHSNOHSN
Carboxylic acidPhenolSulfide

Properties

Molecular formula
C11H8N2O3S2
Molar mass
280.32 g/mol
Exact mass
279.9976 Da
logP
1.95Crippen estimate
Polar surface area
82.8 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
2
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
2591-17-5
SMILES
O=C(O)[C@H]1CSC(c2nc3ccc(O)cc3s2)=N1
InChIKey
BJGNCJDXODQBOB-SSDOTTSWSA-N
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

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Type any one amount. The others follow from the molar mass.

Names and synonyms

14 names · show all
  • 4-Thiazolecarboxylic acid, 4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-, (4S)-
  • 2-Thiazoline-4-carboxylic acid, 2-(6-hydroxy-2-benzothiazolyl)-, (-)-
  • 4-Thiazolecarboxylic acid, 4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-, (S)-
  • (4S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid
  • Luciferin (firefly)
  • Luciferin
  • D-(-)-Luciferin
  • D-Luciferin
  • (S)-Luciferin (firefly)
  • Beetle luciferin
  • BrightGlo
  • (4S)-2-(6-Hydroxybenzothiazol-2-yl)-4,5-dihydrothiazole-4-carboxylic acid
  • BriteLite substrate
  • (4S)-2-(6-Hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid

Work with Firefly luciferin

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere