CHEBI:58406 - 4-amino-4-deoxychorismate(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-amino-4-deoxychorismate(1−)
ChEBI ID CHEBI:58406
ChEBI ASCII Name 4-amino-4-deoxychorismate(1-)
Definition A dicarboxylic acid monoanion that is the conjugate base of 4-amino-4-deoxychorismic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C10H10NO5
Net Charge -1
Average Mass 224.19010
Monoisotopic Mass 224.056
InChI InChI=1S/C10H11NO5/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/p-1/t7-,8-/m1/s1
InChIKey OIUJHGOLFKDBSU-HTQZYQBOSA-M
SMILES [NH3+][C@@H]1C=CC(=C[C@H]1OC(=C)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing 4-amino-4-deoxychorismate(1−) (CHEBI:58406) is a dicarboxylic acid monoanion (CHEBI:35695)
4-amino-4-deoxychorismate(1−) (CHEBI:58406) is conjugate acid of 4-amino-4-deoxychorismate(2−) (CHEBI:35181)
4-amino-4-deoxychorismate(1−) (CHEBI:58406) is conjugate base of 4-amino-4-deoxychorismic acid (CHEBI:18198)
Incoming 4-amino-4-deoxychorismic acid (CHEBI:18198) is conjugate acid of 4-amino-4-deoxychorismate(1−) (CHEBI:58406)
4-amino-4-deoxychorismate(2−) (CHEBI:35181) is conjugate base of 4-amino-4-deoxychorismate(1−) (CHEBI:58406)
IUPAC Name
(3R,4R)-4-ammonio-3-[(1-carboxylatovinyl)oxy]cyclohexa-1,5-diene-1-carboxylate
Last Modified
13 July 2011