CHEBI:116370 - 2-[5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid
ChEBI ID CHEBI:116370
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H15NO5S2
Net Charge 0
Average Mass 401.459
Monoisotopic Mass 401.03916
InChI InChI=1S/C19H15NO5S2/c1-25-14-9-11(7-8-13(14)21)10-15-17(22)20(19(26)27-15)16(18(23)24)12-5-3-2-4-6-12/h2-10,16,21H,1H3,(H,23,24)
InChIKey RYBBZFHEKOTILB-UHFFFAOYSA-N
SMILES COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C(C3=CC=CC=C3)C(=O)O)O
ChEBI Ontology
Outgoing 2-[5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid (CHEBI:116370) is a methoxybenzenes (CHEBI:51683)
2-[5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid (CHEBI:116370) is a phenols (CHEBI:33853)
Manual Xref Database
LSM-27824 LINCS
View more database links