4-Hydroxyphenylglyoxylate

Details

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Internal ID aad7f7df-bb2f-4230-9613-8856e4eaa7d1
Taxonomy Benzenoids > Benzene and substituted derivatives > Benzoyl derivatives
IUPAC Name 2-(4-hydroxyphenyl)-2-oxoacetic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
InChI Key KXFJZKUFXHWWAJ-UHFFFAOYSA-N
Popularity 32 references in papers

Physical and Chemical Properties

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Molecular Formula C8H6O4
Molecular Weight 166.13 g/mol
Exact Mass 166.02660867 g/mol
Topological Polar Surface Area (TPSA) 74.60 Ų
XlogP 1.00

Synonyms

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15573-67-8
Pisolithin A
4-Hydroxyphenylglyoxylate
(4-hydroxyphenyl)(oxo)acetic acid
4-hydroxybenzoylformate
para-Hydroxybenzoylformic acid
CHEBI:28719
DTXSID40165960
2-(4-hydroxyphenyl)-2-oxoacetate
CHEBI:58586
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 4-Hydroxyphenylglyoxylate

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
CHEMBL3194 P02766 Transthyretin 84.53% 90.71%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.18% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.10% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 82.00% 99.17%
CHEMBL4208 P20618 Proteasome component C5 81.99% 90.00%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 81.07% 94.62%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.83% 91.11%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 80.25% 100.00%

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 355
LOTUS LTS0123173
wikiData Q27103861