EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20N2O8S2 |
| Net Charge | 0 |
| Average Mass | 480.520 |
| Monoisotopic Mass | 480.06611 |
| SMILES | CCOC(=O)c1sc2nc(CSCC(=O)OCc3ccc(C(=O)OC)o3)nc(=O)c2c1C |
| InChI | InChI=1S/C20H20N2O8S2/c1-4-28-20(26)16-10(2)15-17(24)21-13(22-18(15)32-16)8-31-9-14(23)29-7-11-5-6-12(30-11)19(25)27-3/h5-6H,4,7-9H2,1-3H3,(H,21,22,24) |
| InChIKey | ROCDSTISGVINIB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[[2-[(5-methoxycarbonyl-2-furanyl)methoxy]-2-oxoethyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester (CHEBI:109224) is a organic heterobicyclic compound (CHEBI:27171) |
| 2-[[[2-[(5-methoxycarbonyl-2-furanyl)methoxy]-2-oxoethyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester (CHEBI:109224) is a organonitrogen heterocyclic compound (CHEBI:38101) |
| 2-[[[2-[(5-methoxycarbonyl-2-furanyl)methoxy]-2-oxoethyl]thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester (CHEBI:109224) is a organosulfur heterocyclic compound (CHEBI:38106) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20621 | LINCS |