Dehydroalanine

Details

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Internal ID 093f499d-2021-4c12-b0b6-f72b4fe3d0ff
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids
IUPAC Name 2-aminoprop-2-enoic acid
SMILES (Canonical) C=C(C(=O)O)N
SMILES (Isomeric) C=C(C(=O)O)N
InChI InChI=1S/C3H5NO2/c1-2(4)3(5)6/h1,4H2,(H,5,6)
InChI Key UQBOJOOOTLPNST-UHFFFAOYSA-N
Popularity 913 references in papers

Physical and Chemical Properties

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Molecular Formula C3H5NO2
Molecular Weight 87.08 g/mol
Exact Mass 87.032028402 g/mol
Topological Polar Surface Area (TPSA) 63.30 Ų
XlogP -0.10

Synonyms

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1948-56-7
2-aminoacrylic acid
2-aminoprop-2-enoic acid
2,3-DIDEHYDROALANINE
2-Aminoacrylate
alpha,beta-Dehydroalanine
alpha-Aminoacrylate
2-Propenoic acid,2-amino-
2-aminoprop-2-enoate
2-AMINO-ACRYLIC ACID
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Dehydroalanine

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!
To see more specific details click the taxa you are interested in.
Arabidopsis thaliana

Cross-Links

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PubChem 123991
LOTUS LTS0193313
wikiData Q1183089