2,10-Dimethyldodeca-2,6,11-triene-1,10-diol

Details

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Internal ID f31a926a-1652-4507-b5ef-899b9366f793
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols
IUPAC Name 2,10-dimethyldodeca-2,6,11-triene-1,10-diol
SMILES (Canonical) CC(=CCCC=CCCC(C)(C=C)O)CO
SMILES (Isomeric) CC(=CCCC=CCCC(C)(C=C)O)CO
InChI InChI=1S/C14H24O2/c1-4-14(3,16)11-9-7-5-6-8-10-13(2)12-15/h4-5,7,10,15-16H,1,6,8-9,11-12H2,2-3H3
InChI Key UZYQOQVQVNHEEQ-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C14H24O2
Molecular Weight 224.34 g/mol
Exact Mass 224.177630004 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 2.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2,10-Dimethyldodeca-2,6,11-triene-1,10-diol

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
CHEMBL3401 O75469 Pregnane X receptor 86.54% 94.73%
CHEMBL2581 P07339 Cathepsin D 86.22% 98.95%
CHEMBL1977 P11473 Vitamin D receptor 85.70% 99.43%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 82.35% 90.93%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 82.33% 97.29%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.73% 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.
Ursinia anethoides

Cross-Links

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PubChem 162900737
LOTUS LTS0121312
wikiData Q105282542