Pyramidamycin B

Details

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Internal ID db6a159e-d9a6-458d-be8a-073dc640cfb9
Taxonomy Benzenoids > Benzene and substituted derivatives > Benzoic acids and derivatives > Salicylic acid and derivatives > Salicylamides
IUPAC Name 2,4-dihydroxy-3-methoxybenzamide
SMILES (Canonical) COC1=C(C=CC(=C1O)C(=O)N)O
SMILES (Isomeric) COC1=C(C=CC(=C1O)C(=O)N)O
InChI InChI=1S/C8H9NO4/c1-13-7-5(10)3-2-4(6(7)11)8(9)12/h2-3,10-11H,1H3,(H2,9,12)
InChI Key MNWIPCLNYWQUBM-UHFFFAOYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C8H9NO4
Molecular Weight 183.16 g/mol
Exact Mass 183.05315777 g/mol
Topological Polar Surface Area (TPSA) 92.80 Ų
XlogP 0.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Pyramidamycin B

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 97.15% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.81% 96.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.73% 95.56%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 86.44% 94.45%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 83.86% 99.15%
CHEMBL4208 P20618 Proteasome component C5 83.62% 90.00%
CHEMBL2535 P11166 Glucose transporter 82.97% 98.75%
CHEMBL3474 P14555 Phospholipase A2 group IIA 82.68% 94.05%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.83% 86.33%

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.
There are no matching plants.

Cross-Links

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PubChem 71482611
LOTUS LTS0028346
wikiData Q75052857