Tecomin

Details

• Internal ID: b49a4f5b-ae9d-4b94-ad22-729783ee092f
• Taxonomy: Phenylpropanoids and polyketides > Tannins > Hydrolyzable tannins
• IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3,4-dimethoxybenzoate
• InChI: InChI=1S/C15H20O9/c1-21-8-4-3-7(5-9(8)22-2)14(20)24-15-13(19)12(18)11(17)10(6-16)23-15/h3-5,10-13,15-19H,6H2,1-2H3
• InChI Key: SSWOBGVMZQWPTN-UHFFFAOYSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₂₀O₉
• Molecular Weight: 344.31 g/mol
• Exact Mass: 344.11073221 g/mol
• Topological Polar Surface Area (TPSA): 135.00 Ų
• XlogP: -1.20

Synonyms

There are no found synonyms.

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	97.15%	96.09%
CHEMBL3060	Q9Y345	Glycine transporter 2	94.26%	99.17%
CHEMBL1293249	Q13887	Kruppel-like factor 5	92.13%	86.33%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	89.79%	96.00%
CHEMBL2581	P07339	Cathepsin D	88.12%	98.95%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	87.82%	91.11%
CHEMBL4208	P20618	Proteasome component C5	86.82%	90.00%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	86.15%	94.00%
CHEMBL3880	P07900	Heat shock protein HSP 90-alpha	84.76%	96.21%
CHEMBL2535	P11166	Glucose transporter	84.47%	98.75%
CHEMBL5608	Q16288	NT-3 growth factor receptor	83.20%	95.89%
CHEMBL241	Q14432	Phosphodiesterase 3A	83.10%	92.94%
CHEMBL1806	P11388	DNA topoisomerase II alpha	82.66%	89.00%
CHEMBL4793	Q86TI2	Dipeptidyl peptidase IX	81.27%	96.95%
CHEMBL4016	P42262	Glutamate receptor ionotropic, AMPA 2	80.67%	86.92%
CHEMBL1255126	O15151	Protein Mdm4	80.64%	90.20%

Plants that contains it

• Tecomella undulata

Cross-Links

• PubChem: 137796461
• LOTUS: LTS0092031
• wikiData: Q105259996