5-(3-Furanyl)-2-methyl-3-penten-2-ol

Details

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Internal ID 59593109-6636-4778-bcaa-b8388014f09a
Taxonomy Organoheterocyclic compounds > Heteroaromatic compounds
IUPAC Name 5-(furan-3-yl)-2-methylpent-3-en-2-ol
SMILES (Canonical) CC(C)(C=CCC1=COC=C1)O
SMILES (Isomeric) CC(C)(C=CCC1=COC=C1)O
InChI InChI=1S/C10H14O2/c1-10(2,11)6-3-4-9-5-7-12-8-9/h3,5-8,11H,4H2,1-2H3
InChI Key XAZOEZDWXXKFEO-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C10H14O2
Molecular Weight 166.22 g/mol
Exact Mass 166.099379685 g/mol
Topological Polar Surface Area (TPSA) 33.40 Ų
XlogP 1.60

Synonyms

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81678-53-7
DTXSID801291913

2D Structure

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2D Structure of 5-(3-Furanyl)-2-methyl-3-penten-2-ol

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
CHEMBL3401 O75469 Pregnane X receptor 92.34% 94.73%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.54% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 86.03% 91.11%
CHEMBL2581 P07339 Cathepsin D 84.63% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 83.21% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.20% 99.17%

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.
Artemisia salsoloides

Cross-Links

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PubChem 538291
LOTUS LTS0095709
wikiData Q105324253