(R)-10-(3-succinimidyl)-TMC-256A1

Details

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Internal ID 6989dee7-25de-45ff-ae31-3db692365b58
Taxonomy Organoheterocyclic compounds > Naphthopyrans
IUPAC Name (3R)-3-(4,5-dihydroxy-6-methoxy-2-methyl-8-oxobenzo[g]chromen-10-yl)pyrrolidine-2,5-dione
SMILES (Canonical) CC1=CC(=C2C(=C3C(=CC(=O)C=C3OC)C(=C2O1)C4CC(=O)NC4=O)O)O
SMILES (Isomeric) CC1=CC(=C2C(=C3C(=CC(=O)C=C3OC)C(=C2O1)[C@H]4CC(=O)NC4=O)O)O
InChI InChI=1S/C19H15NO7/c1-7-3-11(22)16-17(24)15-9(4-8(21)5-12(15)26-2)14(18(16)27-7)10-6-13(23)20-19(10)25/h3-5,10,22,24H,6H2,1-2H3,(H,20,23,25)/t10-/m1/s1
InChI Key ZVZWZNGQYMVVRW-SNVBAGLBSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C19H15NO7
Molecular Weight 369.30 g/mol
Exact Mass 369.08485182 g/mol
Topological Polar Surface Area (TPSA) 122.00 Ų
XlogP -1.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (R)-10-(3-succinimidyl)-TMC-256A1

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 99.78% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 97.12% 94.45%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 96.77% 94.00%
CHEMBL1937 Q92769 Histone deacetylase 2 95.91% 94.75%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 95.60% 85.14%
CHEMBL241 Q14432 Phosphodiesterase 3A 95.52% 92.94%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 94.61% 95.56%
CHEMBL1806 P11388 DNA topoisomerase II alpha 92.71% 89.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 89.76% 93.99%
CHEMBL2581 P07339 Cathepsin D 89.01% 98.95%
CHEMBL3137262 O60341 LSD1/CoREST complex 87.92% 97.09%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.35% 96.09%
CHEMBL2535 P11166 Glucose transporter 85.21% 98.75%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.20% 95.89%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 83.81% 99.23%
CHEMBL217 P14416 Dopamine D2 receptor 83.54% 95.62%
CHEMBL213 P08588 Beta-1 adrenergic receptor 83.33% 95.56%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 82.34% 89.62%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.03% 86.33%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 80.94% 94.42%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 80.88% 96.21%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 80.58% 92.62%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 80.24% 90.71%
CHEMBL4208 P20618 Proteasome component C5 80.04% 90.00%

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 139588439
LOTUS LTS0074172
wikiData Q105384779