CHEBI:121210 - 2-furancarboxylic acid [4-[(2,4-dioxo-5-thiazolidinylidene)methyl]-2-methoxyphenyl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-furancarboxylic acid [4-[(2,4-dioxo-5-thiazolidinylidene)methyl]-2-methoxyphenyl] ester
ChEBI ID CHEBI:121210
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H11NO6S
Net Charge 0
Average Mass 345.328
Monoisotopic Mass 345.03071
InChI InChI=1S/C16H11NO6S/c1-21-12-7-9(8-13-14(18)17-16(20)24-13)4-5-10(12)23-15(19)11-3-2-6-22-11/h2-8H,1H3,(H,17,18,20)
InChIKey INEZCFOATYRSBW-UHFFFAOYSA-N
SMILES COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)S2)OC(=O)C3=CC=CO3
ChEBI Ontology
Outgoing 2-furancarboxylic acid [4-[(2,4-dioxo-5-thiazolidinylidene)methyl]-2-methoxyphenyl] ester (CHEBI:121210) is a benzoate ester (CHEBI:36054)
2-furancarboxylic acid [4-[(2,4-dioxo-5-thiazolidinylidene)methyl]-2-methoxyphenyl] ester (CHEBI:121210) is a phenols (CHEBI:33853)
Manual Xref Database
LSM-32653 LINCS
View more database links