(-)-peniciphenalenin F

Details

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Internal ID bea09f01-0c5c-4dcc-aa74-65aae70f2f9e
Taxonomy Organoheterocyclic compounds > Naphthofurans
IUPAC Name (4S)-7,12-dihydroxy-4,5,5,14-tetramethyl-3,9-dioxatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),7,11,13-pentaen-10-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C17H16O5/c1-6-5-8(18)10-11-9(6)14-12(17(3,4)7(2)21-14)13(19)15(11)22-16(10)20/h5,7,18-19H,1-4H3/t7-/m0/s1
InChI Key FAFDOQOMZPABSD-ZETCQYMHSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C17H16O5
Molecular Weight 300.30 g/mol
Exact Mass 300.09977361 g/mol
Topological Polar Surface Area (TPSA) 76.00 Ų
XlogP 4.20

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (-)-peniciphenalenin 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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 98.70% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 96.04% 95.56%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 92.96% 99.23%
CHEMBL3401 O75469 Pregnane X receptor 92.83% 94.73%
CHEMBL1806 P11388 DNA topoisomerase II alpha 92.45% 89.00%
CHEMBL2581 P07339 Cathepsin D 92.04% 98.95%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 88.55% 94.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 88.20% 99.15%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.30% 86.33%
CHEMBL1937 Q92769 Histone deacetylase 2 85.23% 94.75%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 82.12% 93.03%
CHEMBL4208 P20618 Proteasome component C5 82.04% 90.00%
CHEMBL2553 Q15418 Ribosomal protein S6 kinase alpha 1 81.09% 85.11%
CHEMBL5932 P53671 LIM domain kinase 2 80.27% 96.49%

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 146683111
LOTUS LTS0097575
wikiData Q104992210