Ustusorane F

Details

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Internal ID a6c6bf9b-bc61-4f14-8c44-589b362afc6f
Taxonomy Phenylpropanoids and polyketides > Cinnamyl alcohols
IUPAC Name 2-[7-(hydroxymethyl)-6-[(Z)-3-hydroxyprop-1-enyl]-2,3-dihydro-1-benzofuran-2-yl]propan-2-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H20O4/c1-15(2,18)13-8-11-6-5-10(4-3-7-16)12(9-17)14(11)19-13/h3-6,13,16-18H,7-9H2,1-2H3/b4-3-
InChI Key WRFQSAJQCWCJNX-ARJAWSKDSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C15H20O4
Molecular Weight 264.32 g/mol
Exact Mass 264.13615911 g/mol
Topological Polar Surface Area (TPSA) 69.90 Ų
XlogP 0.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Ustusorane 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 96.47% 91.11%
CHEMBL1293249 Q13887 Kruppel-like factor 5 90.65% 86.33%
CHEMBL3401 O75469 Pregnane X receptor 90.07% 94.73%
CHEMBL3137262 O60341 LSD1/CoREST complex 86.01% 97.09%
CHEMBL1977 P11473 Vitamin D receptor 85.52% 99.43%
CHEMBL2581 P07339 Cathepsin D 84.32% 98.95%
CHEMBL5608 Q16288 NT-3 growth factor receptor 83.94% 95.89%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 83.43% 86.92%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 83.24% 96.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 82.89% 95.56%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.66% 99.17%
CHEMBL3192 Q9BY41 Histone deacetylase 8 81.63% 93.99%
CHEMBL2335 P42785 Lysosomal Pro-X carboxypeptidase 80.53% 100.00%
CHEMBL4829 O00763 Acetyl-CoA carboxylase 2 80.19% 98.00%

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 44557649
LOTUS LTS0065404
wikiData Q77565615