(8R,16R)-(-)-pyrenophorin

Details

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Internal ID 4b2f27af-9b25-4876-9142-494a3ed0824f
Taxonomy Phenylpropanoids and polyketides > Macrolides and analogues
IUPAC Name (3E,8R,11E,16R)-8,16-dimethyl-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H20O6/c1-11-3-5-13(17)8-10-16(20)22-12(2)4-6-14(18)7-9-15(19)21-11/h7-12H,3-6H2,1-2H3/b9-7+,10-8+/t11-,12-/m1/s1
InChI Key PJHRIHGUXQTQLU-NVXYJICISA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C16H20O6
Molecular Weight 308.33 g/mol
Exact Mass 308.12598835 g/mol
Topological Polar Surface Area (TPSA) 86.70 Ų
XlogP 1.30

Synonyms

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SCHEMBL11911415
(8R,16R)-(-)-pyrenophorin

2D Structure

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2D Structure of (8R,16R)-(-)-pyrenophorin

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
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.74% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 88.46% 91.11%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.91% 97.09%
CHEMBL1994 P08235 Mineralocorticoid receptor 84.83% 100.00%
CHEMBL4803 P29474 Nitric-oxide synthase, endothelial 84.79% 86.00%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 84.38% 93.40%
CHEMBL2581 P07339 Cathepsin D 84.09% 98.95%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 83.24% 99.23%
CHEMBL253 P34972 Cannabinoid CB2 receptor 81.42% 97.25%

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 11109605
LOTUS LTS0015089
wikiData Q105209976