AromaDb: A Database of Plant's Aroma Molecules

Delta-Cadinene Details

: IUPAC Name
(1S,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene
:Chemical Class
Alkene
:CAS Registry Number
483-76-1
:Description

:Fragrance Type
rancid

Physical and Chemical properties

PUBCHEM ID441005
Molecular Weight (mg/mol)204.351
Molecular FormulaC15H24
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
IUPAC Name(1S,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene
Canonical SMILESC/C2=C/C1/C(=C(C)CCC1C(C)C)CC2
PUBCHEM IUPAC INCHIKEYFUCYIEXQVQJBKY-ZFWWWQNUSA-N
Solubility Level2
Vapour Pressure-1.671

Absorption and Metabolism information

XLOGP3 AA3.8
CACTVS TPSA0
BBB Level0
Absorption Level1
EXT PPB#Prediction1
AlogP984.939
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 LD501.60776 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
1 483-76-1
2 483-76-1
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 483-76-1 Delta-Cadinene

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Menthol mint, Corn mint, Japanese mint Gomti Mentha arvensis Gomti essential oil
2 Menthol mint, Corn mint, Japanese mint Damroo Mentha arvensis Damroo essential oil
3 Menthol mint, Corn mint, Japanese mint Himalaya Mentha arvensis Himalaya essential oil
4 Menthol mint, Corn mint, Japanese mint Kalka Mentha arvensis Kalka essential oil
5 Menthol mint, Corn mint, Japanese mint Saksham Mentha arvensis Saksham essential oil
6 Menthol mint, Corn mint, Japanese mint Sambhav Mentha arvensis Sambhav essential oil
7 Menthol mint, Corn mint, Japanese mint Kushal Mentha arvensis Kushal essential oil
8 Spearmint Arka Mentha spicata Arka essential oil
9 Spearmint Neerkalka Mentha spicata Neerkalka essential oil
10 Rosemary CIM-Hariyali Rosmarinus officinali CIM-Hariyali essential oil
11 Java Cittronella CIM-Jeeva Cymbopogon winterianus CIM-Jeeva essential oil
12 Java Cittronella CIMAP-Bio-13 Cymbopogon winterianus CIMAP-Bio-13 essential oil
13 Dusky Geranium phaeum essential oil
14 Lemon grass Cymbopogan citratus essential oil
15 Curry tree Murraya koenigii essential oil
16 Holy basil Ocimum tenuiflorum essential oil
17 Pot marigold, ruddles, common marigold, garden marigold, English marigold, or Scottish marigold Calendula officinalis essential oil
18 American wild mint Mentha essential canadensis essential oil
19 Lemon beebalm, Lemon mint Monarda citriodora essential oil
20 Menthol mint, Corn mint, Japanese mint CIM-Saryu Mentha arvensis CIM-Saryu essential oil
21 Java Cittronella Mandakni Cymbopogon winterianus Mandakni essential oil
22 Java Cittronella Manjari Cymbopogon winterianus Manjari essential oil
23 Java Cittronella Manjusha Cymbopogon winterianus Manjusha essential oil
24 American pepper Schinus molle essential oil
25 Pinnate lilac Syringa pinnatifolia essential oil
26 Blackcurrant Ribes nigrum essential oil
27 Hyssopus Hyssopus officinalis essential oil
28 Henna Lawsonia inermis essential oil
29 Abies cephalonica Abies cephalonica essential oil
30 silver fir Abies alba essential oil
31 Abies sachalinensis Abies sachalinensis essential oil
32 sweet yarrow Achillea ageratum essential oil
33 Goatweed Ageratum conyzoides essential oil
34 Golden trumpet Allamanda cathartica essential oil
35 Amyris elimifera Amyris elimifera essential oil
36 Cashew tree Anacardium occidentale essential oil
37 Cashew tree Anacardium occidentale essential oil
38 Anaphalis contorta Anaphalis contorta essential oil
39 Holy Ghost Angelica archangelica essential oil
40 Sitafal Annona cherimola essential oil
41 Sitafal Annona cherimola essential oil
42 Sitafal Annona cherimola essential oil
43 Custard apple Annona reticulata essential oil
44 Star Thistle Honey Centaurea calcitrapa essential oil
45 Star Thistle Honey Centaurea calcitrapa essential oil
46 Chikras Chukrasia tabularis essential oil
47 Fireweed Crassocephalum crepidioides essential oil
48 Fireweed Crassocephalum crepidioides essential oil
49 Cupressus sempervirens Cupressus sempervirens essential oil
50 Courbaril Hymenaea courbaril essential oil
51 Satureja hortensis Satureja hortensis essential oil
52 White horehound Marrubium vulgare essential oil
53 Hibiscus surattensis Hibiscus surattensis essential oil

Compound Image


2D Structure

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(External database - ChemAxon)