Pochonin G

Details

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Internal ID cdc1b619-38e8-445f-8dd6-aa41bc48c04d
Taxonomy Phenylpropanoids and polyketides > Macrolides and analogues
IUPAC Name (3R,5S,7R)-14-chloro-11,13-dihydroxy-7-methyl-4,8,20-trioxatetracyclo[15.2.1.03,5.010,15]icosa-1(19),10(15),11,13,17-pentaen-9-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H17ClO6/c1-8-4-14-15(25-14)6-10-3-2-9(24-10)5-11-16(18(22)23-8)12(20)7-13(21)17(11)19/h2-3,7-8,14-15,20-21H,4-6H2,1H3/t8-,14+,15-/m1/s1
InChI Key CFVKDYMHTACQOE-UKXDHYTESA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C18H17ClO6
Molecular Weight 364.80 g/mol
Exact Mass 364.0713660 g/mol
Topological Polar Surface Area (TPSA) 92.40 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Pochonin 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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 99.17% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 96.28% 91.49%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 93.72% 95.56%
CHEMBL2581 P07339 Cathepsin D 93.21% 98.95%
CHEMBL4208 P20618 Proteasome component C5 91.74% 90.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.24% 86.33%
CHEMBL3401 O75469 Pregnane X receptor 90.02% 94.73%
CHEMBL217 P14416 Dopamine D2 receptor 89.88% 95.62%
CHEMBL1806 P11388 DNA topoisomerase II alpha 88.20% 89.00%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 87.79% 93.40%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 87.24% 94.45%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 83.04% 90.71%
CHEMBL2094127 P06493 Cyclin-dependent kinase 1/cyclin B 82.72% 96.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 81.35% 94.00%
CHEMBL3137262 O60341 LSD1/CoREST complex 80.76% 97.09%
CHEMBL5608 Q16288 NT-3 growth factor receptor 80.61% 95.89%

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 139583256
LOTUS LTS0136253
wikiData Q104957072