(2R,3Z)-2-aminohexa-3,5-dienoic acid

Details

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Internal ID 490befec-e934-4bf9-9dbc-dfcca14469fd
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids > D-alpha-amino acids
IUPAC Name (2R,3Z)-2-aminohexa-3,5-dienoic acid
SMILES (Canonical) C=CC=CC(C(=O)O)N
SMILES (Isomeric) C=C/C=C\[C@H](C(=O)O)N
InChI InChI=1S/C6H9NO2/c1-2-3-4-5(7)6(8)9/h2-5H,1,7H2,(H,8,9)/b4-3-/t5-/m1/s1
InChI Key LAVTULVXLBWEBX-CLBPYYFESA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C6H9NO2
Molecular Weight 127.14 g/mol
Exact Mass 127.063328530 g/mol
Topological Polar Surface Area (TPSA) 63.30 Ų
XlogP -1.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2R,3Z)-2-aminohexa-3,5-dienoic 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
CHEMBL4246 P42680 Tyrosine-protein kinase TEC 90.48% 82.05%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 84.06% 96.09%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 83.94% 94.45%
CHEMBL3060 Q9Y345 Glycine transporter 2 82.88% 99.17%
CHEMBL340 P08684 Cytochrome P450 3A4 82.05% 91.19%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 80.79% 95.56%

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 101935694
LOTUS LTS0134217
wikiData Q105149004