AromaDb: A Database of Plant's Aroma Molecules

Cyclosantalal Details

: IUPAC Name
Cyclosantalal
:Chemical Class
Aldehyde
:CAS Registry Number
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID101925674
Molecular Weight (mg/mol)
Molecular Formula
Hydrogen Bond Donor Count
Hydrogen Bond Acceptor Count
Rotatable Bond Count
IUPAC NameCyclosantalal
Canonical SMILESCC(C=O)C2CCC3(C)C1CCC(C1)C23C
PUBCHEM IUPAC INCHIKEY
Solubility Level2
Vapour Pressure

Absorption and Metabolism information

XLOGP3 AA
CACTVS TPSA
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP983.328
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDAMulti-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDAMulti-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD503.00481 g/kg_body_weight
Ocular IrritancyMild
Hepatotoxic#Prediction0
Effected Human Genes

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Moderate
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 Cyclosantalal

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Chandan Santalum album essential oil

Compound Image


2D Structure

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(External database - ChemAxon)