3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraenal

Details

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Internal ID 9f99eb96-5537-4ead-99a5-db7772b3339b
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Acyclic diterpenoids
IUPAC Name 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenal
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H32O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15-16H,6-8,10,12,14H2,1-5H3
InChI Key AVHRJMXIKKJVHG-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C20H32O
Molecular Weight 288.50 g/mol
Exact Mass 288.245315640 g/mol
Topological Polar Surface Area (TPSA) 17.10 Ų
XlogP 6.70

Synonyms

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FT-0774939

2D Structure

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2D Structure of 3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraenal

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
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 94.15% 92.08%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 88.13% 96.09%
CHEMBL3401 O75469 Pregnane X receptor 87.22% 94.73%
CHEMBL2581 P07339 Cathepsin D 85.09% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.92% 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.
Mikania sessilifolia

Cross-Links

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PubChem 53644254
LOTUS LTS0012071
wikiData Q104919513