Euphorbiaproliferin G

Details

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Internal ID ce98a459-b642-4c36-b21c-172367e6efcf
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Pentacarboxylic acids and derivatives
IUPAC Name [(1R,2R,3R,4S,5S,7R,8S,9R,10R,11S,14R)-2,7,8,14-tetraacetyloxy-5,9-dimethyl-11-prop-1-en-2-yl-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-4-yl] propanoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C31H42O11/c1-10-23(36)41-25-16(4)13-31(42-20(8)35)24(25)27(39-18(6)33)30-14-37-29(9,28(31)40-19(7)34)26(30)21(15(2)3)11-12-22(30)38-17(5)32/h11-12,16,21-22,24-28H,2,10,13-14H2,1,3-9H3/t16-,21+,22+,24+,25-,26-,27+,28-,29+,30+,31+/m0/s1
InChI Key KQHUWYDTRJJUNN-PMGAOPNISA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C31H42O11
Molecular Weight 590.70 g/mol
Exact Mass 590.27271215 g/mol
Topological Polar Surface Area (TPSA) 141.00 Ų
XlogP 3.40

Synonyms

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CHEBI:69718
CHEMBL1927836
Q27138061

2D Structure

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2D Structure of Euphorbiaproliferin G

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 98.91% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 98.81% 97.25%
CHEMBL4040 P28482 MAP kinase ERK2 97.48% 83.82%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 97.10% 91.11%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 92.09% 96.95%
CHEMBL2581 P07339 Cathepsin D 91.07% 98.95%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 88.64% 94.45%
CHEMBL340 P08684 Cytochrome P450 3A4 87.10% 91.19%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 86.57% 89.34%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 85.87% 94.33%
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 84.83% 96.77%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 84.38% 97.21%
CHEMBL2996 Q05655 Protein kinase C delta 83.80% 97.79%
CHEMBL1806 P11388 DNA topoisomerase II alpha 83.63% 89.00%
CHEMBL3137262 O60341 LSD1/CoREST complex 82.73% 97.09%
CHEMBL218 P21554 Cannabinoid CB1 receptor 82.14% 96.61%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.11% 86.33%
CHEMBL1994 P08235 Mineralocorticoid receptor 81.97% 100.00%
CHEMBL221 P23219 Cyclooxygenase-1 81.65% 90.17%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.65% 99.17%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 81.26% 94.80%
CHEMBL5255 O00206 Toll-like receptor 4 81.05% 92.50%

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.
Euphorbia prolifera

Cross-Links

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PubChem 56601279
LOTUS LTS0087738
wikiData Q27138061