Dendronpholide C

Details

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Internal ID 09c17876-e889-4257-a786-68263a0e0ad4
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Cembrane diterpenoids
IUPAC Name methyl 2-[(1R,3S,4E,7E,11S,12R)-3,11,12-trihydroxy-4,8,12-trimethylcyclotetradeca-4,7-dien-1-yl]prop-2-enoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C21H34O5/c1-14-7-6-8-15(2)18(22)13-17(16(3)20(24)26-5)11-12-21(4,25)19(23)10-9-14/h7-8,17-19,22-23,25H,3,6,9-13H2,1-2,4-5H3/b14-7+,15-8+/t17-,18+,19+,21-/m1/s1
InChI Key NULPWFRFJXKLME-BJLPOFMISA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C21H34O5
Molecular Weight 366.50 g/mol
Exact Mass 366.24062418 g/mol
Topological Polar Surface Area (TPSA) 87.00 Ų
XlogP 2.10

Synonyms

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CHEMBL479785

2D Structure

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2D Structure of Dendronpholide C

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 96.52% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.91% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 92.62% 97.25%
CHEMBL1871 P10275 Androgen Receptor 87.01% 96.43%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.69% 95.56%
CHEMBL2007 P16234 Platelet-derived growth factor receptor alpha 86.40% 91.07%
CHEMBL5028 O14672 ADAM10 85.47% 97.50%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 85.05% 93.03%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.20% 97.09%
CHEMBL1994 P08235 Mineralocorticoid receptor 83.19% 100.00%
CHEMBL1907602 P06493 Cyclin-dependent kinase 1/cyclin B1 82.65% 91.24%
CHEMBL5608 Q16288 NT-3 growth factor receptor 82.21% 95.89%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 80.40% 99.23%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 80.34% 94.45%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 80.06% 94.33%

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 24970576
LOTUS LTS0122276
wikiData Q105185936