AromaDb: A Database of Plant's Aroma Molecules

Beta-Pinene Details

: IUPAC Name
6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane
:Chemical Class
:CAS Registry Number
127-91-3
:Description

:Fragrance Type
resinous piney aroma

Physical and Chemical properties

PUBCHEM ID14896
Molecular Weight (mg/mol)136.234
Molecular FormulaC10H16
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
IUPAC Name6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane
Canonical SMILESC=C1CCC2CC1C2(C)C
PUBCHEM IUPAC INCHIKEYWTARULDDTDQWMU-UHFFFAOYSA-N
Solubility Level3
Vapour Pressure0.358

Absorption and Metabolism information

XLOGP3 AA3.1
CACTVS TPSA0
BBB Level0
Absorption Level0
EXT PPB#Prediction1
AlogP982.926
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 LD503.16492 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
1 127-91-3 VIP Rattus norvegicus beta-pinene results in increased expression of VIP protein increases^expression 20934418
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 127-91-3 Beta-Pinene

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 Menthol mint, Corn mint, Japanese mint MAS-1 Mentha arvensis MAS-1 essential oil
3 Menthol mint, Corn mint, Japanese mint Gomti Mentha arvensis Gomti essential oil
4 Menthol mint, Corn mint, Japanese mint Himalaya Mentha arvensis Himalaya essential oil
5 Menthol mint, Corn mint, Japanese mint Kosi Mentha arvensis Kosi essential oil
6 Menthol mint, Corn mint, Japanese mint Damroo Mentha arvensis Damroo essential oil
7 Menthol mint, Corn mint, Japanese mint Kalka Mentha arvensis Kalka essential oil
8 Menthol mint, Corn mint, Japanese mint Sambhav Mentha arvensis Sambhav essential oil
9 Menthol mint, Corn mint, Japanese mint Kushal Mentha arvensis Kushal essential oil
10 Menthol mint, Corn mint, Japanese mint Saksham Mentha arvensis Saksham essential oil
11 Peppermint CIM-Madhuras Mentha piperita CIm-Madhuras essential oil
12 Peppermint CIMAP-Patra Mentha piperita CIMAP-Patra essential oil
13 Peppermint Kukrail Mentha piperita Kukrail essential oil
14 Fennel, Saunf CIM-sujal Foeniculum vulgare CIM-Sujal essential oil
15 Peppermint Tushar Mentha piperita Tushar essential oil
16 Sweet flag, Vach, Bhoja CIM-Balya Acorus calamus CIM-Balya essential oil
17 Bergot mint Kiran Mentha citrata Kiran essential oil
18 Chamomile, German chamomile, Gule-babuna Vallary Chamomilla recutita Vallary essential oil
19 Peppermint CIM-Indus Mentha piperita CIM-Indus essential oil
20 Chamomile, German chamomile, Gule-babuna Prasant Chamomilla recutita Prasant essential oil
21 Clarysage CIM-Chandni Salvia sclarea CIM-Chandni essential oil
22 French basil, Indian basil, Sweet basil Vikarsudha Ocimum basilicum vikarsudha essential oil
23 Spearmint Arka Mentha spicata Arka essential oil
24 Spearmint MSS-5 Mentha spicata MSS-5 essential oil
25 Spearmint Neera Mentha spicata Neera essential oil
26 Spearmint Neerkalka Mentha spicata Neerkalka essential oil
27 Geranium Pelargonium roseum essential oil
28 Lemongrass Cauvery Cymbopogon flexuosus Cauvery essential oil
29 Cymbopogon Cymbopogon nardus essential oil
30 Curry tree Murraya koenigii essential oil
31 Hornem Ocimum ciliatum essential oil
32 Holy basil Ocimum tenuiflorum essential oil
33 Horsechestnut Aesculus hippocastanum essential oil
34 Pot marigold, ruddles, common marigold, garden marigold, English marigold, or Scottish marigold Calendula officinalis essential oil
35 American wild mint Mentha essential canadensis essential oil
36 Oliveria Oliveria decumbens essential oil
37 Clarysage Salvia officinalis essential oil
38 Menthol mint, Corn mint, Japanese mint CIM-Kranti Mentha arvensis CIM-Kranti essential oil
39 Menthol mint, Corn mint, Japanese mint CIM-Saryu Mentha arvensis CIM-Saryu essential oil
40 Sweet wormwood, Quinghao Jeevanraksha Artemisia annua Jeevanraksha essential oil
41 Lemongrass Pragati Cymbopogon flexuosus Pragati essential oil
42 Lemongrass Nima Cymbopogon flexuosus Nima essential oil
43 Lemongrass Krishna Cymbopogon flexuosus krishna essential oil
44 Lemongrass Praman Cymbopogon flexuosus praman essential oil
45 Java Cittronella Jalpallavi Cymbopogon winterianus Jalpallavi essential oil
46 Java Cittronella Medini Cymbopogon winterianus Medni essential oil
47 Water dropwort Oenanthe crocata essential oil
48 Water dropwort Oenanthe crocata essential oil
49 Levisticum officinalis Levisticum aofficinalis essential oil
50 Languas galanga Alpinia galanga essential oil
51 White turmeric Curcuma zedoaria essential oil
52 Kuth Saussurea lappa essential oil
53 American pepper Schinus molle essential oil
54 Oregano Origanum vulgare essential oil
55 Feverfew Tanacetum parthenium essential oil
56 Sweet violet Viola odorata essential oil
57 Garden angelica Angelica archangelican essential oil
58 Gum rockrose Cistus ladanifer essential oil
59 Gum rockrose Cistus ladanifer ESSENTIAL OIL
60 Blackcurrant Ribes nigrum essential oil
61 Southern magnolia Magnolia grandiflora essential oil
62 Horse Mint Mentha longifolia essential oil
63 Broadleaved lavender, spike lavender or Portuguese lavender Lavandula latifolia essential oil
64 Catnip, Catswort, or Catmint Nepeta cataria essential oil
65 Bay laurel, Sweet bay, Bay tree Laurus nobilis essential oil
66 Hyssopus Hyssopus officinalis essential oil
67 Common hop Humulus lupulus essential oil
68 Common yarrow Achillea millefolium essential oil
69 Mexican pepperleaf Piper auritum essential oil
70 Mexican pepperleaf Piper auritum essential oil
71 Pistachio Pistacia vera essential oil
72 Bulgarian fir Abies borisii-regis essential oil
73 Abies cephalonica Abies cephalonica essential oil
74 silver fir Abies alba essential oil
75 Abies sachalinensis Abies sachalinensis essential oil
76 Shampoo ginger. Bitter ginger Zingiber zerumbet essential oil
77 sweet yarrow Achillea ageratum essential oil
78 Aframomum stipulatum Aframomum stipulatum
79 Goatweed Ageratum conyzoides essential oil
80 Yellow bugle Ajuga chamaepitys essential oil
81 Shell ginger Alpinia zerumbet essential oil
82 Black cardamom Amomum subulatum essential oil
83 Amyris elimifera Amyris elimifera essential oil
84 Anethum graveolens Anethum graveolens essential oil
85 Custard apple Annona reticulata essential oil
86 Chervil Anthriscus cerefolium essential oil
87 Artemisia dracunculus Artemisia dracunculus essential oil
88 Artemisia dracunculus Artemisia dracunculus essential oil
89 Bixa orellana Bixa orellana essential oil
90 Bottlebrushes Callistemon citrinus essential oil
91 Bushkiller Cayratia japonica essential oil
92 Bushkiller Cayratia japonica essential oil
93 Bramhi Centella asiatica essential oil
94 Bramhi Centella asiatica essential oil
95 Chaerophyllum villosum Chaerophyllum villosum essential oil
96 Chaerophyllum villosum Chaerophyllum villosum essential oil
97 Chrysanthemum coronarium Chrysanthemum indicum essential oil
98 Mums Chrysanthemum indicum essential oil
99 Coriandrum Sativum Coriandrum sativum essential oil
100 Coriandrum Sativum Coriandrum sativum essential oil
101 Cupressus sempervirens Cupressus sempervirens essential oil
102 Narrow-leaved turmeric Curcuma angustifolia essential oil
103 Wild carrot Daucus carota ssp. carota essential oil
104 Wild carrot Daucus carota essential oil
105 Vietnamese Balm Elsholtzia ciliata essential oil
106 Satureja hortensis Satureja hortensis essential oil
107 Southern blue-gum Eucalyptus globulus essential oil
108 Pitanga Eugenia uniflora essential oil

Compound Image


2D Structure

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