(2E,6E,10S)-2,6,10-trimethyldodeca-2,6,11-triene-1,10-diol

Details

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Internal ID 8435d9d9-c52b-4116-af16-65f034cabc0b
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name (2E,6E,10S)-2,6,10-trimethyldodeca-2,6,11-triene-1,10-diol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H26O2/c1-5-15(4,17)11-7-10-13(2)8-6-9-14(3)12-16/h5,9-10,16-17H,1,6-8,11-12H2,2-4H3/b13-10+,14-9+/t15-/m1/s1
InChI Key YXIFOKDKHGSQOB-GXBUMDJISA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C15H26O2
Molecular Weight 238.37 g/mol
Exact Mass 238.193280068 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 3.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2E,6E,10S)-2,6,10-trimethyldodeca-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 88.05% 94.73%
CHEMBL2581 P07339 Cathepsin D 87.85% 98.95%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 85.79% 92.08%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.92% 99.17%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 80.94% 90.93%

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 alpina
Ursinia nana

Cross-Links

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PubChem 162879935
LOTUS LTS0130185
wikiData Q105367702