CHEBI:183477 - 2-{2-[4-(tert-butyl)phenyl]-4-hydroxy-1,3-thiazol-5-yl}acetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-{2-[4-(tert-butyl)phenyl]-4-hydroxy-1,3-thiazol-5-yl}acetic acid
ChEBI ID CHEBI:183477
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H17NO3S
Net Charge 0
Average Mass 291.370
Monoisotopic Mass 291.09291
InChI InChI=1S/C15H17NO3S/c1-15(2,3)10-6-4-9(5-7-10)14-16-13(19)11(20-14)8-12(17)18/h4-7,19H,8H2,1-3H3,(H,17,18)
InChIKey VUCFIEJHQDKXBJ-UHFFFAOYSA-N
SMILES S1C(=NC(O)=C1CC(O)=O)C2=CC=C(C(C)(C)C)C=C2
Metabolite of Species Details
Bombus terrestris (NCBI:txid30195) Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in brain (BTO:0000142). See: MetaboLights Study
ChEBI Ontology
Outgoing 2-{2-[4-(tert-butyl)phenyl]-4-hydroxy-1,3-thiazol-5-yl}acetic acid (CHEBI:183477) is a alkylbenzene (CHEBI:38976)
IUPAC Name
2-[2-(4-tert-butylphenyl)-4-hydroxy-1,3-thiazol-5-yl]acetic acid
Manual Xref Database
2087730 ChemSpider
View more database links