2-Amino-muconic acid

Details

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Internal ID fc660b8a-d34a-4d72-b499-94428705aba8
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids
IUPAC Name (2E,4Z)-2-aminohexa-2,4-dienedioic acid
SMILES (Canonical) C(=CC(=O)O)C=C(C(=O)O)N
SMILES (Isomeric) C(=C\C(=O)O)\C=C(/C(=O)O)\N
InChI InChI=1S/C6H7NO4/c7-4(6(10)11)2-1-3-5(8)9/h1-3H,7H2,(H,8,9)(H,10,11)/b3-1-,4-2+
InChI Key ZRHONLCTYUYMIQ-HSFFGMMNSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C6H7NO4
Molecular Weight 157.12 g/mol
Exact Mass 157.03750770 g/mol
Topological Polar Surface Area (TPSA) 101.00 Ų
XlogP -0.30

Synonyms

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(2E,4Z)-2-aminohexa-2,4-dienedioic acid
RefChem:1062217
o-Aminomuconate
2-aminohexa-2,4-dienedioate
trans,cis-2-aminomuconic acid
SCHEMBL1332095
(2E,4Z)-2-aminomuconic acid
CHEBI:189698
LMFA01170082
(2E,4Z)-2-Aminohexa-2,4-dienedioate
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 2-Amino-muconic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
No predicted targets yet!

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 5280499
LOTUS LTS0131217
wikiData Q61484203