AromaDb: A Database of Plant's Aroma Molecules

Gamma-Cadinene Details

: IUPAC Name
(1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
:Chemical Class
:CAS Registry Number
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID92313
Molecular Weight (mg/mol)204.351
Molecular FormulaC15H24
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
IUPAC Name(1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Canonical SMILESC=C1CCC(C(C)C)C2/C=C(C)CCC12
PUBCHEM IUPAC INCHIKEYWRHGORWNJGOVQY-RBSFLKMASA-N
Solubility Level2
Vapour Pressure-1.697

Absorption and Metabolism information

XLOGP3 AA4.3
CACTVS TPSA0
BBB Level0
Absorption Level1
EXT PPB#Prediction1
AlogP984.798
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 LD501.71847 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 Gamma-Cadinene

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Menthol mint, Corn mint, Japanese mint MAS-1 Mentha arvensis MAS-1 essential oil
2 Menthol mint, Corn mint, Japanese mint Himalaya Mentha arvensis Himalaya essential oil
3 Menthol mint, Corn mint, Japanese mint Kosi Mentha arvensis Kosi essential oil
4 Menthol mint, Corn mint, Japanese mint Kalka Mentha arvensis Kalka essential oil
5 Menthol mint, Corn mint, Japanese mint Sambhav Mentha arvensis Sambhav essential oil
6 Menthol mint, Corn mint, Japanese mint Kushal Mentha arvensis Kushal essential oil
7 French basil, Indian basil, Sweet basil CIM-Sharada Ocimum basilicum CIM-Sharada essential oil
8 Lavendula angustifolia Sher-e-Kashmir Lavandula angustifolia sher-e-Kashmir essential oil
9 Lemon grass Cymbopogan citratus essential oil
10 Hornem Ocimum ciliatum essential oil
11 Pot marigold, ruddles, common marigold, garden marigold, English marigold, or Scottish marigold Calendula officinalis essential oil
12 Menthol mint, Corn mint, Japanese mint CIM-Kranti Mentha arvensis CIM-Kranti essential oil
13 Menthol mint, Corn mint, Japanese mint CIM-Saryu Mentha arvensis CIM-Saryu essential oil
14 Sweet wormwood, Quinghao Jeevanraksha Artemisia annua Jeevanraksha essential oil
15 American pepper Schinus molle essential oil
16 Oregano Origanum vulgare essential oil
17 Gum rockrose Cistus ladanifer essential oil
18 Gum rockrose Cistus ladanifer ESSENTIAL OIL
19 Bulgarian fir Abies borisii-regis essential oil
20 Abies cephalonica Abies cephalonica essential oil
21 silver fir Abies alba essential oil
22 Ginger Zingiber officinale essential oil
23 sweet yarrow Achillea ageratum essential oil
24 Garlic Allium sativum essential oil
25 Yellow bugle Ajuga chamaepitys essential oil
26 Lemon verbena Aloysia citrodora essential oil
27 Cashew tree Anacardium occidentale essential oil
28 Cashew tree Anacardium occidentale essential oil
29 Anaphalis contorta Anaphalis contorta essential oil
30 Sitafal Annona cherimola essential oil
31 Sitafal Annona cherimola essential oil
32 Sitafal Annona cherimola essential oil
33 Custard apple Annona reticulata essential oil
34 Cupressus sempervirens Cupressus sempervirens essential oil
35 Courbaril Hymenaea courbaril essential oil
36 Pitanga Eugenia uniflora essential oil

Compound Image


2D Structure

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(External database - ChemAxon)