EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | CHNS |
| Net Charge | 0 |
| Average Mass | 59.093 |
| Monoisotopic Mass | 58.98297 |
| SMILES | N#CS |
| InChI | InChI=1S/CHNS/c2-1-3/h3H |
| InChIKey | ZMZDMBWJUHKJPS-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Escherichia coli (ncbitaxon:562) | - | PubMed (21988831) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| thiocyanic acid (CHEBI:29200) has role Escherichia coli metabolite (CHEBI:76971) |
| thiocyanic acid (CHEBI:29200) is a hydracid (CHEBI:33405) |
| thiocyanic acid (CHEBI:29200) is a one-carbon compound (CHEBI:64708) |
| thiocyanic acid (CHEBI:29200) is a organosulfur compound (CHEBI:33261) |
| thiocyanic acid (CHEBI:29200) is conjugate acid of thiocyanate (CHEBI:18022) |
| thiocyanic acid (CHEBI:29200) is tautomer of isothiocyanic acid (CHEBI:24928) |
| Incoming Relation(s) |
| nitridosulfidocarbon(•) (CHEBI:29425) has functional parent thiocyanic acid (CHEBI:29200) |
| thiocyanates (CHEBI:26955) has functional parent thiocyanic acid (CHEBI:29200) |
| thiocyanate (CHEBI:18022) is conjugate base of thiocyanic acid (CHEBI:29200) |
| isothiocyanic acid (CHEBI:24928) is tautomer of thiocyanic acid (CHEBI:29200) |
| IUPAC Names |
|---|
| nitridosulfanidocarbon |
| thiocyanic acid |
| Synonyms | Source |
|---|---|
| Thiocyanic acid | KEGG COMPOUND |
| HSCN | IUPAC |
| [C(N)(SH)] | IUPAC |
| [CN(SH)] | IUPAC |
| N≡C‒SH | ChEBI |
| HS‒C≡N | ChEBI |