AromaDb: A Database of Plant's Aroma Molecules

Eicosanol Details

: IUPAC Name
icosoxy(trimethyl)silane
:Chemical Class
Alcohol
:CAS Registry Number
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID6431467
Molecular Weight (mg/mol)370.728
Molecular FormulaC23H50OSi
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count20
IUPAC Nameicosoxy(trimethyl)silane
Canonical SMILESCCCCCCCCCCCCCCCCCCCCO[Si](C)(C)C
PUBCHEM IUPAC INCHIKEYCFOOEWBGIAYIIK-UHFFFAOYSA-N
Solubility Level0
Vapour Pressure-5.501

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA9.2
BBB Level4
Absorption Level3
EXT PPB#Prediction1
AlogP9810.588
EXT CYP2D6#Prediction1

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityNon-Toxic
Rat Oral LD5045.2536 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human Genes

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Mild
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 Eicosanol

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Yellow bugle Ajuga chamaepitys essential oil
2 Holy Ghost Angelica archangelica essential oil

Compound Image


2D Structure

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(External database - ChemAxon)