(2Z)-2-chlorododeca-2,11-dien-1-ol

Details

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Internal ID 644bbd69-e58b-4b8c-ab74-987385100da5
Taxonomy Organohalogen compounds > Halohydrins > Chlorohydrins
IUPAC Name (2Z)-2-chlorododeca-2,11-dien-1-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C12H21ClO/c1-2-3-4-5-6-7-8-9-10-12(13)11-14/h2,10,14H,1,3-9,11H2/b12-10-
InChI Key JHQNGVFZTHPLMQ-BENRWUELSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C12H21ClO
Molecular Weight 216.75 g/mol
Exact Mass 216.1280930 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 4.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2Z)-2-chlorododeca-2,11-dien-1-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
CHEMBL1829 O15379 Histone deacetylase 3 94.77% 95.00%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 91.01% 89.34%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 90.16% 97.29%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.45% 91.11%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 88.03% 96.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.39% 99.17%
CHEMBL2885 P07451 Carbonic anhydrase III 81.52% 87.45%
CHEMBL3975 P09467 Fructose-1,6-bisphosphatase 80.74% 92.95%

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 21597450
LOTUS LTS0095304
wikiData Q105128164