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 ID 14896
Molecular Weight (g/mol) 136.234
Molecular Formula C10H16
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 0
IUPAC Name 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane
Canonical SMILES C=C1CCC2CC1C2(C)C
PUBCHEM IUPAC INCHIKEY WTARULDDTDQWMU-UHFFFAOYSA-N
Solubility Level 3
Vapour Pressure 0.358

Absorption and Metabolism information

XLOGP3 AA 3.1
CACTVS TPSA 0
BBB Level 0
Absorption Level 0
EXT PPB#Prediction 1
AlogP98 2.926
EXT CYP2D6#Prediction 0

Toxicological Information

Mouse Female FDA Multi-Carcinogen
Mouse Male FDA Multi-Carcinogen
Rat Female FDA Single-Carcinogen
Rat Male FDA Multi-Carcinogen
Ames Prediction Non-Mutagen
Developmental / Reproductive Toxicity Toxic
Rat Oral LD50 3.16492 g/kg_body_weight
Ocular Irritancy Mild
Hepatotoxic#Prediction 0
Effected Human Genes

Ecological Information

Aerobic Biodegradability Prediction Degradable

Hazard(s) Identification

Physical hazards not classified
Health hazards Moderate
Environmental hazards not classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteractionInteraction Actions PubMed Id
1127-91-3VIPRattus norvegicusbeta-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 Bergot mint Kiran Mentha citrata Kiran essential oil
2 Chamomile, German chamomile, Gule-babuna Vallary Chamomilla recutita Vallary essential oil
3 Chamomile, German chamomile, Gule-babuna Prasant Chamomilla recutita Prasant essential oil
4 Clarysage CIM-Chandni Salvia sclarea CIM-Chandni essential oil
5 French basil, Indian basil, Sweet basil Vikarsudha Ocimum basilicum vikarsudha essential oil
6 Spearmint Arka Mentha spicata Arka essential oil
7 Spearmint MSS-5 Mentha spicata MSS-5 essential oil
8 Spearmint Neera Mentha spicata Neera essential oil
9 Spearmint Neerkalka Mentha spicata Neerkalka essential oil
10 Geranium Pelargonium roseum essential oil
11 Holy Basil, Tulsi CIM-Angana Ocimum sanctum CIM-Angana essential oil
12 Lemongrass Cauvery Cymbopogon flexuosus Cauvery essential oil
13 Citronella Cymbopogon nardus essential oil
14 Curry tree Murraya koenigii essential oil
15 Hornem Ocimum ciliatum essential oil
16 Holy basil Ocimum tenuiflorum essential oil
17 Horsechestnut Aesculus hippocastanum essential oil
18 Pot marigold, ruddles, common marigold, garden marigold, English marigold, or Scottish marigold Calendula officinalis essential oil
19 American wild mint Mentha essential canadensis essential oil
20 Oliveria Oliveria decumbens essential oil
21 Clarysage Salvia officinalis essential oil
22 Menthol mint, Corn mint, Japanese mint Gomti Mentha arvensis Gomti essential oil
23 Menthol mint, Corn mint, Japanese mint CIM-Kranti Mentha arvensis CIM-Kranti essential oil
24 Menthol mint, Corn mint, Japanese mint CIM-Saryu Mentha arvensis CIM-Saryu essential oil
25 Menthol mint, Corn mint, Japanese mint Damroo Mentha arvensis Damroo essential oil
26 Menthol mint, Corn mint, Japanese mint Himalaya Mentha arvensis Himalaya essential oil
27 Fennel, Saunf CIM-sujal Foeniculum vulgare CIM-Sujal essential oil
28 Menthol mint, Corn mint, Japanese mint Kalka Mentha arvensis Kalka essential oil
29 Menthol mint, Corn mint, Japanese mint Kosi Mentha arvensis Kosi essential oil
30 Menthol mint, Corn mint, Japanese mint Kushal Mentha arvensis Kushal essential oil
31 Menthol mint, Corn mint, Japanese mint MAS-1 Mentha arvensis MAS-1 essential oil
32 Menthol mint, Corn mint, Japanese mint Saksham Mentha arvensis Saksham essential oil
33 Menthol mint, Corn mint, Japanese mint Sambhav Mentha arvensis Sambhav essential oil
34 Peppermint CIM-Madhuras Mentha piperita CIm-Madhuras essential oil
35 Peppermint CIM-Indus Mentha piperita CIM-Indus essential oil
36 Peppermint CIMAP-Patra Mentha piperita CIMAP-Patra essential oil
37 Peppermint Kukrail Mentha piperita Kukrail essential oil
38 Peppermint Tushar Mentha piperita Tushar essential oil
39 Lemongrass Pragati Cymbopogon flexuosus Pragati essential oil
40 Lemongrass Nima Cymbopogon flexuosus Nima essential oil
41 Lemongrass Krishna Cymbopogon flexuosus krishna essential oil
42 Lemongrass Praman Cymbopogon flexuosus praman essential oil
43 Java Cittronella Jalpallavi Cymbopogon winterianus Jalpallavi essential oil
44 Java Cittronella Medini Cymbopogon winterianus Medni essential oil
45 Water dropwort Oenanthe crocata essential oil
46 Water dropwort Oenanthe crocata essential oil
47 Sweet flag, Vach, Bhoja CIM-Balya Acorus calamus CIM-Balya essential oil
48 Levisticum officinalis Levisticum aofficinalis essential oil
49 Languas galanga Alpinia galanga essential oil
50 White turmeric Curcuma zedoaria essential oil
51 Kuth Saussurea lappa essential oil
52 American pepper Schinus molle essential oil
53 Oregano Origanum vulgare essential oil
54 Feverfew Tanacetum parthenium essential oil
55 Sweet violet Viola odorata essential oil
56 Garden angelica Angelica archangelican essential oil
57 Gum rockrose Cistus ladanifer essential oil
58 Gum rockrose Cistus ladanifer ESSENTIAL OIL
59 Blackcurrant Ribes nigrum essential oil
60 Southern magnolia Magnolia grandiflora essential oil
61 Horse Mint Mentha longifolia essential oil
62 Sweet wormwood, Quinghao Jeevanraksha Artemisia annua Jeevanraksha 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 Dill 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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