EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H11IO3S |
| Net Charge | 0 |
| Average Mass | 386.210 |
| Monoisotopic Mass | 385.94736 |
| SMILES | [H]OC(=O)[C@]([H])(c1c([H])c([H])c(C(=O)c2sc(I)c([H])c2[H])c([H])c1[H])C([H])([H])[H] |
| InChI | InChI=1S/C14H11IO3S/c1-8(14(17)18)9-2-4-10(5-3-9)13(16)11-6-7-12(15)19-11/h2-8H,1H3,(H,17,18)/t8-/m0/s1 |
| InChIKey | UIZPHGUBGPJBAR-QMMMGPOBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| P-(2'-IODO-5'-THENOYL)HYDROTROPIC ACID (CHEBI:43491) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (2S)-2-{4-[(5-iodothiophen-2-yl)carbonyl]phenyl}propanoic acid | PDBeChem |
| P-(2'-IODO-5'-THENOYL)HYDROTROPIC ACID | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| ISF | PDBeChem |