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CHEBI:29514 - 5-amino-5-deoxy-3-dehydroshikimic acid
| Formula | C7H9NO4 |
| Net Charge | 0 |
| Average Mass | 171.152 |
| Monoisotopic Mass | 171.05316 |
| SMILES | N[C@@H]1CC(C(=O)O)=CC(=O)[C@H]1O |
| InChI | InChI=1S/C7H9NO4/c8-4-1-3(7(11)12)2-5(9)6(4)10/h2,4,6,10H,1,8H2,(H,11,12)/t4-,6+/m1/s1 |
| InChIKey | NTKDYXWKDJOXSZ-XINAWCOVSA-N |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) has functional parent shikimic acid (CHEBI:16119) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is a 4-oxo monocarboxylic acid (CHEBI:35950) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is a 5-hydroxy monocarboxylic acid (CHEBI:37125) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is a enone (CHEBI:51689) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is a secondary α-hydroxy ketone (CHEBI:2468) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is a γ-amino acid (CHEBI:33707) |
| 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) is tautomer of 5-amino-5-deoxy-3-dehydroshikimic acid zwitterion (CHEBI:71963) |
| Incoming Relation(s) |
| 5-amino-5-deoxy-3-dehydroshikimic acid zwitterion (CHEBI:71963) is tautomer of 5-amino-5-deoxy-3-dehydroshikimic acid (CHEBI:29514) |
| IUPAC Name |
|---|
| (4S,5R)-5-amino-4-hydroxy-3-oxocyclohex-1-ene-1-carboxylic acid |
| Synonyms | Source |
|---|---|
| AminoDHS | KEGG COMPOUND |
| 5-Deoxy-5-amino-3-dehydroshikimic acid | KEGG COMPOUND |
| Citations |
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