Chondrosterin F

Details

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Internal ID a211f99e-fdfe-45fc-98bc-1ff8b9381b47
Taxonomy Organoheterocyclic compounds > Pyrans > Pyranones and derivatives > Dihydropyranones
IUPAC Name (2R,6S)-3,3,11,11-tetramethyl-7-oxatricyclo[7.3.0.02,6]dodec-1(9)-ene-4,8,10-trione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H18O4/c1-14(2)6-7-10(12(14)17)13(18)19-8-5-9(16)15(3,4)11(7)8/h8,11H,5-6H2,1-4H3/t8-,11-/m0/s1
InChI Key YPJVNNBPZVIFLM-KWQFWETISA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C15H18O4
Molecular Weight 262.30 g/mol
Exact Mass 262.12050905 g/mol
Topological Polar Surface Area (TPSA) 60.40 Ų
XlogP 1.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Chondrosterin F

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
CHEMBL230 P35354 Cyclooxygenase-2 94.24% 89.63%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.52% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.96% 95.56%
CHEMBL262 P49841 Glycogen synthase kinase-3 beta 87.73% 95.72%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 87.55% 99.23%
CHEMBL2039 P27338 Monoamine oxidase B 84.64% 92.51%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.60% 97.09%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 83.98% 96.09%
CHEMBL221 P23219 Cyclooxygenase-1 82.06% 90.17%
CHEMBL3351 Q13085 Acetyl-CoA carboxylase 1 81.04% 93.04%

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 139586293
LOTUS LTS0126314
wikiData Q77503338