1,6,10,14-Hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-

Details

• Internal ID: d782ee0c-d7d1-41fd-8a64-dc0c60ae4bcf
• Taxonomy: Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Acyclic diterpenoids
• IUPAC Name: 3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol
• SMILES (Canonical): CC(=CCCC(=CCCC(=CCCC(C)(C=C)O)C)C)C
• SMILES (Isomeric): CC(=CCCC(=CCCC(=CCCC(C)(C=C)O)C)C)C
• InChI: InChI=1S/C20H34O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,11,13,15,21H,1,8-10,12,14,16H2,2-6H3
• InChI Key: IQDXAJNQKSIPGB-UHFFFAOYSA-N
• Popularity: 1 reference in papers

Physical and Chemical Properties

• Molecular Formula: C₂₀H₃₄O
• Molecular Weight: 290.50 g/mol
• Exact Mass: 290.260965704 g/mol
• Topological Polar Surface Area (TPSA): 20.20 Ų
• XlogP: 6.40

Synonyms

• 1,6,10,14-Hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-
• DTXSID40862543
• IQDXAJNQKSIPGB-UHFFFAOYSA-N
• FT-0626667
• FT-0668971

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL4769	O95749	Geranylgeranyl pyrophosphate synthetase	94.05%	92.08%
CHEMBL3401	O75469	Pregnane X receptor	90.60%	94.73%
CHEMBL2581	P07339	Cathepsin D	87.00%	98.95%
CHEMBL5966	P55899	IgG receptor FcRn large subunit p51	84.45%	90.93%
CHEMBL4657	Q6V1X1	Dipeptidyl peptidase VIII	80.21%	97.21%
CHEMBL3060	Q9Y345	Glycine transporter 2	80.16%	99.17%

Plants that contains it

• Duhaldea cuspidata
• Geigeria burkei
• Helichrysum nanum
• Mikania luetzelburgii
• Picea obovata

Cross-Links

• PubChem: 92862
• LOTUS: LTS0208423
• wikiData: Q82854396