AromaDb: A Database of Plant's Aroma Molecules

Germacrene D Details

: IUPAC Name
(1Z,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene
:Chemical Class
Sesquiterpene
:CAS Registry Number
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID5373727
Molecular Weight (mg/mol)204.351
Molecular FormulaC15H24
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
IUPAC Name(1Z,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene
Canonical SMILESC=C1/C=CC(C(C)C)CC/C(C)=CCC1
PUBCHEM IUPAC INCHIKEYGAIBLDCXCZKKJE-BZXLUOIMSA-N
Solubility Level2
Vapour Pressure-1.806

Absorption and Metabolism information

XLOGP3 AA4.7
CACTVS TPSA0
BBB Level0
Absorption Level1
EXT PPB#Prediction1
AlogP985.134
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 LD501.4148 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 Germacrene D

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Holy Basil, Tulsi CIM-Angana Ocimum sanctum CIM-Angana essential oil
2 Holy Basil, Tulsi CIM-Kanchan Ocimum sanctum CIM-Kanchan essential oil
3 Menthol mint, Corn mint, Japanese mint Gomti Mentha arvensis Gomti essential oil
4 Menthol mint, Corn mint, Japanese mint MAS-1 Mentha arvensis MAS-1 essential oil
5 Menthol mint, Corn mint, Japanese mint Damroo Mentha arvensis Damroo essential oil
6 Menthol mint, Corn mint, Japanese mint Himalaya Mentha arvensis Himalaya essential oil
7 Menthol mint, Corn mint, Japanese mint Kosi Mentha arvensis Kosi essential oil
8 Menthol mint, Corn mint, Japanese mint Kalka Mentha arvensis Kalka essential oil
9 Menthol mint, Corn mint, Japanese mint Saksham Mentha arvensis Saksham essential oil
10 Menthol mint, Corn mint, Japanese mint Sambhav Mentha arvensis Sambhav essential oil
11 Menthol mint, Corn mint, Japanese mint Kushal Mentha arvensis Kushal essential oil
12 Peppermint CIM-Madhuras Mentha piperita CIm-Madhuras essential oil
13 Peppermint Pranjal Mentha piperita Pranjal essential oil
14 Peppermint CIMAP-Patra Mentha piperita CIMAP-Patra essential oil
15 Peppermint Kukrail Mentha piperita Kukrail essential oil
16 Peppermint Tushar Mentha piperita Tushar essential oil
17 Peppermint CIM-Indus Mentha piperita CIM-Indus essential oil
18 Spearmint Neerkalka Mentha spicata Neerkalka essential oil
19 Lavendula angustifolia Sher-e-Kashmir Lavandula angustifolia sher-e-Kashmir essential oil
20 Java Cittronella CIM-Jeeva Cymbopogon winterianus CIM-Jeeva essential oil
21 Java Cittronella CIMAP-Bio-13 Cymbopogon winterianus CIMAP-Bio-13 essential oil
22 Hook Cymbopogon microstachys essential oil
23 Pot marigold, ruddles, common marigold, garden marigold, English marigold, or Scottish marigold Calendula officinalis essential oil
24 American wild mint Mentha essential canadensis essential oil
25 Menthol mint, Corn mint, Japanese mint CIM-Kranti Mentha arvensis CIM-Kranti essential oil
26 Menthol mint, Corn mint, Japanese mint CIM-Saryu Mentha arvensis CIM-Saryu essential oil
27 Sweet wormwood, Quinghao CIM-Arogya Artemisia annua CIM-Arogya essential oil
28 Sweet wormwood, Quinghao Jeevanraksha Artemisia annua Jeevanraksha essential oil
29 Java Cittronella Mandakni Cymbopogon winterianus Mandakni essential oil
30 Java Cittronella Manjari Cymbopogon winterianus Manjari essential oil
31 Lemongrass CIMAP-Suwarna Cymbopogon flexuosus CIMAP-Suwarna essential oil
32 Lemongrass Pragati Cymbopogon flexuosus Pragati essential oil
33 Lemongrass T-1 Cymbopogon flexuosus T-1 essential oil
34 Java Cittronella Jalpallavi Cymbopogon winterianus Jalpallavi essential oil
35 American pepper Schinus molle essential oil
36 Southern magnolia Magnolia grandiflora essential oil
37 Clove basil, African basil Ocimum gratissimum essential oil
38 Horse Mint Mentha longifolia essential oil
39 Bay laurel, Sweet bay, Bay tree Laurus nobilis essential oil
40 Henna Lawsonia inermis essential oil
41 Garden heliotrope Heliotropium floridum essential oil
42 Crimson beebalm, Scarlet beebalm Crimson beebalm essential oil
43 Bulgarian fir Abies borisii-regis essential oil
44 Abies cephalonica Abies cephalonica essential oil
45 silver fir Abies alba essential oil
46 Shampoo ginger. Bitter ginger Zingiber zerumbet essential oil
47 sweet yarrow Achillea ageratum essential oil
48 Goatweed Ageratum conyzoides essential oil
49 Golden trumpet Allamanda cathartica essential oil
50 Amyris elimifera Amyris elimifera essential oil
51 Cashew tree Anacardium occidentale essential oil
52 Cashew tree Anacardium occidentale essential oil
53 Sitafal Annona cherimola essential oil
54 Sitafal Annona cherimola essential oil
55 Sitafal Annona cherimola essential oil
56 Custard apple Annona reticulata essential oil
57 Artemisia dracunculus Artemisia dracunculus essential oil
58 Artemisia dracunculus Artemisia dracunculus essential oil
59 Bauhinia ungulata Bauhinia ungulata essential oil
60 Bauhinia ungulata Bauhinia ungulata essential oil
61 Bauhinia ungulata Bauhinia ungulata essential oil
62 Star Thistle Honey Centaurea calcitrapa essential oil
63 Star Thistle Honey Centaurea calcitrapa essential oil
64 Bramhi Centella asiatica essential oil
65 Bramhi Centella asiatica essential oil
66 Centratherum punctatum Centratherum punctatum essential oil
67 Centratherum punctatum Centratherum punctatum essential oil
68 Chrysanthemum coronarium Chrysanthemum indicum essential oil
69 Mums Chrysanthemum indicum essential oil
70 Wild basil Clinopodium vulgare essential oil
71 Wild carrot Daucus carota ssp. carota essential oil
72 Dictamnus albus Dictamnus albus essential oil
73 Satureja hortensis Satureja hortensis essential oil
74 White horehound Marrubium vulgare essential oil
75 Hibiscus surattensis Hibiscus surattensis essential oil

Compound Image


2D Structure

Download




Download Sdf File Download PDB File Download MOL File
View Similar Structures
(External database - ChemAxon)