BBT(OH)2 (CHEBI:187150)

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ChEBI Ontology

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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	BBT(OH)2

ChEBI ID	CHEBI:187150

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H8O2S

Net Charge

Average Mass

168.210

Monoisotopic Mass

168.02450

InChI

InChI=1S/C8H8O2S/c9-6-7(10)3-4-8-2-1-5-11-8/h1-2,5,7,9-10H,6H2

InChIKey

DJUPJQDYDPZCJZ-UHFFFAOYSA-N

SMILES

S1C(=CC=C1)C#CC(O)CO

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	BBT(OH)2 (CHEBI:187150) is a heteroarene (CHEBI:33833)

IUPAC Name

4-thiophen-2-ylbut-3-yne-1,2-diol