Dihydro-cinnamic acid

Details

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Internal ID 8cb60a1b-d71f-4568-8d5d-05dfa54abba2
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acids
IUPAC Name 3-cyclohexa-2,4-dien-1-ylprop-2-enoic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-4,6-8H,5H2,(H,10,11)
InChI Key KJBYDOBMZHMKBD-UHFFFAOYSA-N
Popularity 5 references in papers

Physical and Chemical Properties

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Molecular Formula C9H10O2
Molecular Weight 150.17 g/mol
Exact Mass 150.068079557 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 1.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Dihydro-cinnamic 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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 87.36% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.20% 96.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 81.13% 95.56%

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.
Isotachis japonica

Cross-Links

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PubChem 53997381
LOTUS LTS0098749
wikiData Q105141773