(2E,4E,10E)-dodeca-2,4,10-trien-6,8-diyn-1-ol

Details

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Internal ID 7e11e6d6-43ef-432f-ba0e-e7c8b6c798d2
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols
IUPAC Name (2E,4E,10E)-dodeca-2,4,10-trien-6,8-diyn-1-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C12H12O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-3,8-11,13H,12H2,1H3/b3-2+,9-8+,11-10+
InChI Key NOUPECCRGPYHGL-MMOYHAHMSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C12H12O
Molecular Weight 172.22 g/mol
Exact Mass 172.088815002 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 2.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2E,4E,10E)-dodeca-2,4,10-trien-6,8-diyn-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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.78% 96.09%
CHEMBL3492 P49721 Proteasome Macropain subunit 81.32% 90.24%

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 11030297
LOTUS LTS0053222
wikiData Q105182817