CAY10638 (CHEBI:188345)

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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	CAY10638

ChEBI ID	CHEBI:188345

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H13NO3S2

Net Charge

Average Mass

331.400

Monoisotopic Mass

331.03369

InChI

InChI=1S/C16H13NO3S2/c18-15-14(22-16(19)17-15)10-11-3-5-12(6-4-11)20-8-7-13-2-1-9-21-13/h1-6,9-10H,7-8H2,(H,17,18,19)/b14-10-

InChIKey

NTKWOUHXDKSPIX-UVTDQMKNSA-N

SMILES

S1C(CCOC2=CC=C(C=C2)/C=C/3\SC(=O)NC3=O)=CC=C1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

ChEBI Ontology
Outgoing	CAY10638 (CHEBI:188345) is a aromatic ether (CHEBI:35618)

IUPAC Name

(5Z)-5-[[4-(2-thiophen-2-ylethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione