Trideca-1,3,5-trien-7,9,11-triyne

Details

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Internal ID 9753a9df-4f13-4c76-8c54-32f255eb6769
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Enynes
IUPAC Name trideca-1,3,5-trien-7,9,11-triyne
SMILES (Canonical) CC#CC#CC#CC=CC=CC=C
SMILES (Isomeric) CC#CC#CC#CC=CC=CC=C
InChI InChI=1S/C13H10/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3,5,7,9,11H,1H2,2H3
InChI Key AJWRNFIZKHPOHC-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C13H10
Molecular Weight 166.22 g/mol
Exact Mass 166.078250319 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Trideca-1,3,5-trien-7,9,11-triyne

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
CHEMBL3227 P41594 Metabotropic glutamate receptor 5 88.13% 96.42%

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 koidzumii
Artemisia vulgaris
Artemisia vulgaris subsp. vulgaris
Buphthalmum salicifolium
Carthamus tinctorius
Cirsium helenioides
Flaveria trinervia
Flourensia heterolepis
Glebionis carinata

Cross-Links

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PubChem 528756
LOTUS LTS0246027
wikiData Q104913445