Heptadeca-1,8,11,14-tetraene

Details

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Internal ID f1eb323e-5cae-4073-ab52-e362078d190d
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkatetraenes
IUPAC Name heptadeca-1,8,11,14-tetraene
SMILES (Canonical) CCC=CCC=CCC=CCCCCCC=C
SMILES (Isomeric) CCC=CCC=CCC=CCCCCCC=C
InChI InChI=1S/C17H28/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3,6,8,12,14-15,17H,1,4-5,7,9-11,13,16H2,2H3
InChI Key JXRNMQDTJAQLAQ-UHFFFAOYSA-N
Popularity 5 references in papers

Physical and Chemical Properties

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Molecular Formula C17H28
Molecular Weight 232.40 g/mol
Exact Mass 232.219100893 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 6.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Heptadeca-1,8,11,14-tetraene

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
CHEMBL239 Q07869 Peroxisome proliferator-activated receptor alpha 95.46% 90.75%
CHEMBL3060 Q9Y345 Glycine transporter 2 88.85% 99.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 88.03% 96.09%
CHEMBL2581 P07339 Cathepsin D 87.87% 98.95%
CHEMBL221 P23219 Cyclooxygenase-1 86.26% 90.17%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.32% 86.33%

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.
Aucklandia costus
Carthamus tinctorius
Centaurea cineraria subsp. cineraria
Centaurea nervosa
Centaurea nicolai
Centaurea scabiosa
Cheirolophus canariensis
Cirsium canum
Cirsium helenioides
Pleiotaxis rugosa
Silphium perfoliatum

Cross-Links

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PubChem 82660
LOTUS LTS0222542
wikiData Q82000193