EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:16775 - 3-aci-nitropropanoic acid
| Formula | C3H5NO4 |
| Net Charge | 0 |
| Average Mass | 119.076 |
| Monoisotopic Mass | 119.02186 |
| SMILES | O=C(O)CC=[N+]([O-])O |
| InChI | InChI=1S/C3H5NO4/c5-3(6)1-2-4(7)8/h2H,1H2,(H,5,6)(H,7,8) |
| InChIKey | DCSLGQYKPBZRHI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-aci-nitropropanoic acid (CHEBI:16775) is a aci-nitro compound (CHEBI:136622) |
| 3-aci-nitropropanoic acid (CHEBI:16775) is conjugate acid of 3-(dioxido-λ5-azanylidene)propanoate(2−) (CHEBI:57892) |
| 3-aci-nitropropanoic acid (CHEBI:16775) is conjugate acid of 3-aci-nitropropanoate (CHEBI:136067) |
| 3-aci-nitropropanoic acid (CHEBI:16775) is tautomer of 3-nitropropanoic acid (CHEBI:16348) |
| Incoming Relation(s) |
| 3-(dioxido-λ5-azanylidene)propanoate(2−) (CHEBI:57892) is conjugate base of 3-aci-nitropropanoic acid (CHEBI:16775) |
| 3-aci-nitropropanoate (CHEBI:136067) is conjugate base of 3-aci-nitropropanoic acid (CHEBI:16775) |
| 3-nitropropanoic acid (CHEBI:16348) is tautomer of 3-aci-nitropropanoic acid (CHEBI:16775) |
| IUPAC Names |
|---|
| 3-[hydroxy(oxido)-λ5-azanylidene]propanoic acid |
| 3-aci-nitropropanoic acid |
| Synonyms | Source |
|---|---|
| 3-aci-Nitoropropionic acid | KEGG COMPOUND |
| 3-(hydroxynitrorylidene)propanoic acid | IUPAC |
| 3-[hydroxy(oxido)imino]propanoic acid | IUPAC |
| 3-aci-Nitropropionic acid | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C03071 | KEGG COMPOUND |