CHEBI:109756 - 3-[4-oxo-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[4-oxo-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid
ChEBI ID CHEBI:109756
Stars This entity has been manually annotated by a third party.
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Formula C16H15NO4S2
Net Charge 0
Average Mass 349.427
Monoisotopic Mass 349.04425
InChI InChI=1S/C16H15NO4S2/c1-2-9-21-12-5-3-11(4-6-12)10-13-15(20)17(16(22)23-13)8-7-14(18)19/h2-6,10H,1,7-9H2,(H,18,19)
InChIKey AEZGVSCOIZTTBC-UHFFFAOYSA-N
SMILES C=CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O
ChEBI Ontology
Outgoing 3-[4-oxo-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid (CHEBI:109756) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-21184 LINCS
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