3,7,11,15,19-Pentamethylicosa-6,10,14,18-tetraen-1-ol

Details

• Internal ID: 36ac9381-e667-4d7c-be4b-d4fa2e4fbcb9
• Taxonomy: Lipids and lipid-like molecules > Prenol lipids > Polyprenols > Dolichols
• IUPAC Name: 3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraen-1-ol
• SMILES (Canonical): CC(CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)CCO
• SMILES (Isomeric): CC(CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)CCO
• InChI: InChI=1S/C25H44O/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-26/h11,13,15,17,25-26H,7-10,12,14,16,18-20H2,1-6H3
• InChI Key: KLGBTYNAYAZPFD-UHFFFAOYSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₂₅H₄₄O
• Molecular Weight: 360.60 g/mol
• Exact Mass: 360.339216023 g/mol
• Topological Polar Surface Area (TPSA): 20.20 Ų
• XlogP: 8.80

Synonyms

There are no found synonyms.

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	93.46%	92.08%
CHEMBL2581	P07339	Cathepsin D	91.19%	98.95%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	90.97%	96.09%
CHEMBL2107	P61073	C-X-C chemokine receptor type 4	88.33%	93.10%
CHEMBL2885	P07451	Carbonic anhydrase III	85.52%	87.45%
CHEMBL3401	O75469	Pregnane X receptor	83.43%	94.73%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	82.84%	94.45%
CHEMBL3060	Q9Y345	Glycine transporter 2	82.12%	99.17%
CHEMBL3892	Q99500	Sphingosine 1-phosphate receptor Edg-3	82.12%	97.29%
CHEMBL3359	P21462	Formyl peptide receptor 1	81.64%	93.56%

Plants that contains it

• Glycine max

Cross-Links

• PubChem: 54000506
• LOTUS: LTS0173366
• wikiData: Q104391626