AromaDb: A Database of Plant's Aroma Molecules

1-Tetracosanol Details

: IUPAC Name
tetracosan-1-ol
:Chemical Class
Alcohol
:CAS Registry Number
506-51-4
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID 10472
Molecular Weight (g/mol) 354.653
Molecular Formula C24H50O
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 22
IUPAC Name tetracosan-1-ol
Canonical SMILES CCCCCCCCCCCCCCCCCCCCCCCCO
PUBCHEM IUPAC INCHIKEY TYWMIZZBOVGFOV-UHFFFAOYSA-N
Solubility Level 1
Vapour Pressure -7.352

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA 20.2
BBB Level 4
Absorption Level 3
EXT PPB#Prediction 1
AlogP98 10.094
EXT CYP2D6#Prediction 1

Toxicological Information

Mouse Female FDA Non-Carcinogen
Mouse Male FDA Multi-Carcinogen
Rat Female FDA Single-Carcinogen
Rat Male FDA Non-Carcinogen
Ames Prediction Non-Mutagen
Developmental / Reproductive Toxicity Toxic
Rat Oral LD50 18.1407 g/kg_body_weight
Ocular Irritancy None
Hepatotoxic#Prediction 0
Effected Human Genes

Ecological Information

Aerobic Biodegradability Prediction Degradable

Hazard(s) Identification

Physical hazards not classified
Health hazards Mild
Environmental hazards not classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteractionInteraction Actions PubMed Id
1506-51-4
Serial No. Activity Name DetailsReferences (PubMed)Other details EPA (U.S) Clinical Trials (U.S. NIH)
1 506-51-4 1-Tetracosanol

Plant Variety and Essential oils

Serial No. Plant NameVariety NameEssential OilCompound Percentage
1 Psyllium, isabgol or isabhghula Niharika Plantago ovata Niharika essential oil

Compound Image


2D Structure

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