Exact Mass: 152.1201
Exact Mass Matches: 152.1201
Found 500 metabolites which its exact mass value is equals to given mass value 152.1201,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Camphor
Camphor appears as a colorless or white colored crystalline powder with a strong mothball-like odor. About the same density as water. Emits flammable vapors above 150 °F. Used to make moth proofings, pharmaceuticals, and flavorings. Camphor is a cyclic monoterpene ketone that is bornane bearing an oxo substituent at position 2. A naturally occurring monoterpenoid. It has a role as a plant metabolite. It is a bornane monoterpenoid and a cyclic monoterpene ketone. Camphor is a natural product found in Xylopia aromatica, Xylopia sericea, and other organisms with data available. A bicyclic monoterpene ketone found widely in plants, especially CINNAMOMUM CAMPHORA. It is used topically as a skin antipruritic and as an anti-infective agent. A cyclic monoterpene ketone that is bornane bearing an oxo substituent at position 2. A naturally occurring monoterpenoid. C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D000890 - Anti-Infective Agents relative retention time with respect to 9-anthracene Carboxylic Acid is 0.986 Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2]. Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2].
Perillyl alcohol
Perillyl alcohol is a monoterpene isolated from the essential oils of lavendin, peppermint, spearmint, cherries, celery seeds, and several other plants. In animal studies it has been shown to regress pancreatic, mammary, and liver tumors, to exhibit possible application as a chemopreventative agent for colon, skin, and lung cancer, and as a chemotherapeutic agent for neuroblastoma, and prostate and colon cancer.(PMID: 9855569) [HMDB]. p-Mentha-1,8-dien-7-ol is found in many foods, some of which are caraway, ginger, german camomile, and sweet bay. (S)-(-)-perillyl alcohol is a perillyl alcohol in which the chiral centre has S configuration. It is an enantiomer of a (R)-(+)-perillyl alcohol. Perillyl alcohol is under investigation in clinical trial NCT02704858 (Safety and Efficacy Study in Recurrent Grade IV Glioma). (-)-Perillyl alcohol is a natural product found in Teucrium pestalozzae, Canella winterana, and other organisms with data available. See also: Paeonia lactiflora root (part of). Perillyl alcohol is a monoterpene isolated from the essential oils of lavendin, peppermint, spearmint, cherries, celery seeds, and several other plants. In animal studies it has been shown to regress pancreatic, mammary, and liver tumors, to exhibit possible application as a chemopreventative agent for colon, skin, and lung cancer, and as a chemotherapeutic agent for neuroblastoma, and prostate and colon cancer.(PMID:9855569). C471 - Enzyme Inhibitor > C2020 - Farnesyl Transferase Inhibitor D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1]. (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1]. Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1]. Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1].
(-)-3-Isothujone
(-)-3-Isothujone is found in alcoholic beverages. Ingredient of absinthe. Presence in food and beverages regulated by legislation.Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. (Wikipedia (-)-alpha-thujone is the (1S,4R,5R)-stereoisomer of alpha-thujone. It is an enantiomer of a (+)-alpha-thujone. alpha-Thujone is a natural product found in Xylopia sericea, Rhododendron mucronulatum, and other organisms with data available. See also: Artemisia absinthium whole (part of). A thujane monoterpenoid that is thujane substituted by an oxo group at position 3. Ingredient of absinthe. Presence in food and beverages regulated by legislation α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3].
Pulegone
A p-menthane monoterpenoid that is cyclohexan-1-one substituted by a methyl group at position 5 and a propan-2-ylidene group at position 2. Occurs in oils of Mentha subspecies, Hedeoma pulegioides and many other essential oils. Fragrance and flavour ingredient. (R)-p-Menth-4(8)-en-3-one is found in many foods, some of which are blackcurrant, pepper (c. frutescens), spearmint, and red bell pepper. Pulegone, the major chemical constituent of Nepeta catariaessential oil which is an aromatic herb, is one of avian repellents[1]. The molecular target for the repellent action of Pulegone in avian species is nociceptive TRP ankyrin 1 (TRPA1). Pulegone stimulates both TRPM8 and TRPA1 channel in chicken sensory neurons and suppresses the former but not the latter at high concentrations[2]. Pulegone, the major chemical constituent of Nepeta catariaessential oil which is an aromatic herb, is one of avian repellents[1]. The molecular target for the repellent action of Pulegone in avian species is nociceptive TRP ankyrin 1 (TRPA1). Pulegone stimulates both TRPM8 and TRPA1 channel in chicken sensory neurons and suppresses the former but not the latter at high concentrations[2].
(+)-Camphor
Camphor, also known as (+)-camphor or (+)-bornan-2-one, is a member of the class of compounds known as bicyclic monoterpenoids. Bicyclic monoterpenoids are monoterpenoids containing exactly 2 rings, which are fused to each other. Camphor is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Within the cell, camphor is primarily located in the membrane (predicted from logP). Camphor is a waxy, flammable, white or transparent solid with a strong aroma. It is a terpenoid with the chemical formula C10H16O. It is found in many plants, such as in the wood of the camphor laurel (Cinnamomum camphora), a large evergreen tree found in Asia (particularly in Sumatra and Borneo islands, Indonesia) and also of the unrelated Kapur tree, a tall timber tree from the same region. It also occurs in some other related trees in the laurel family, notably Ocotea usambarensis and in the oil in rosemary leaves (Rosmarinus officinalis). The mint family contains 10 to 20\\\\\\\\% camphor, while camphorweed (Heterotheca) only contains some 5\\\\\\\\%. Camphor can also be synthetically produced from oil of turpentine. It is used for its scent, as an ingredient in cooking (mainly in India), as an embalming fluid, for medicinal purposes, and in religious ceremonies. A major source of camphor in Asia is camphor basil (the parent of African blue basil) (Wikipedia). (R)-camphor is the (R)- enantiomer of camphor. It is an enantiomer of a (S)-camphor. Camphor is a bicyclic monoterpene ketone found widely in plants, especially Cinnamomum camphora. It is used topically as a skin antipruritic and as an anti-infective agent. When ingested, camphor has a rapid onset of toxic effects, and camphorated oil is the product most often responsible for its toxicity. The FDA ruled that camphorated oil could not be marketed in the United States and that no product could contain a concentration higher than 11\\\\\\\\%. It appears in the list of drug products withdrawn or removed from the market for safety or effectiveness. However, camphor can be found in several nonprescription medications at lower concentrations. D-Camphor is a natural product found in Chromolaena odorata, Curcuma amada, and other organisms with data available. See also: Coriander Oil (part of). C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent C - Cardiovascular system > C01 - Cardiac therapy The (R)- enantiomer of camphor. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative. Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2]. Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2].
Geranial
Geranial, also known as 3,7-dimethyl-2,6-octadienal, citral or lemonal, belongs to the class of organic compounds known as acyclic monoterpenoids. These are monoterpenes that do not contain a cycle. Thus, citral is considered to be an isoprenoid lipid. Two different isomers of 3,7-dimethyl-2,6-octadienal exist. The E-isomer or trans-isomer is known as geranial or citral A. The Z-isomer or cis-isomer is known as neral or citral B. 3,7-dimethyl-2,6-octadienal is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Citral is present in the oils of several plants, including lemon myrtle (90-98\\\\%), Litsea citrata (90\\\\%), Litsea cubeba, lemongrass (65-80\\\\%), lemon tea-tree (70-80\\\\%), Ocimum gratissimum, Lindera citriodora, Calypranthes parriculata, petitgrain, lemon verbena, lemon ironbark, lemon balm, lime, lemon and orange. Citral has also been reported to be found in Cannabis sativa (PMID:6991645 , 26657499 ). Citral has a strong lemon (citrus) odor. Nerals lemon odor is less intense, but sweeter. Citral is therefore an aroma compound used in perfumery for its citrus effect. Citral is also used as a flavor and for fortifying lemon oil. It has strong antimicrobial qualities (PMID:28974979 ) and pheromonal effects in nematodes and insects (PMID:26973536 ). Citral is used in the synthesis of vitamin A, lycopene, ionone, and methylionone (a compound used to mask the smell of smoke). Occurs in lemon grass oil (Cymbopogon citratus), lemon, orange and many other essential oils; flavouring ingredient. Geranial is found in many foods, some of which are watermelon, nutmeg, cloud ear fungus, and yellow wax bean. Citral is a monoterpene found in Cymbopogon citratus essential oil, with antihyperalgesic, anti-nociceptive and anti-inflammatory effects[1]. Citral is a monoterpene found in Cymbopogon citratus essential oil, with antihyperalgesic, anti-nociceptive and anti-inflammatory effects[1].
Alpha-Pinene-oxide
Alpha-pinene oxide is cheap monoterpene, which is important compound for the fragnance industry. Biocatalytic method is used to convert monoterpenes into terpenoids. The biotransformation of alpha-pinene oxide using resting cells of Pseudomonas fluorescens NCIMB 11671 produces isonovalal (cis-2-methyl-5-isopropylhexa-2,5-dienal), which is a fragrance. However, this biotransformation has technical problems including the following: alpha-pinene oxide undergoes autoxidation in water and light; it is hydrophobic and relatively toxic to the biocatalyst; and it suffers from product inhibition. the influence of other terpene byproducts on the flux of alpha-pinene oxide was investigated and found to decrease the flux into the organic phase by up to 10\\%. (PMID: 16321051) [HMDB] Alpha-pinene oxide is cheap monoterpene, which is important compound for the fragnance industry. Biocatalytic method is used to convert monoterpenes into terpenoids. The biotransformation of alpha-pinene oxide using resting cells of Pseudomonas fluorescens NCIMB 11671 produces isonovalal (cis-2-methyl-5-isopropylhexa-2,5-dienal), which is a fragrance. However, this biotransformation has technical problems including the following: alpha-pinene oxide undergoes autoxidation in water and light; it is hydrophobic and relatively toxic to the biocatalyst; and it suffers from product inhibition. the influence of other terpene byproducts on the flux of alpha-pinene oxide was investigated and found to decrease the flux into the organic phase by up to 10\\%. (PMID: 16321051).
(-)-trans-Carveol
Carveol is a natural terpenoid alcohol that is a constituent of spearmint oil. It has an odor and flavor that resemble those of spearmint and caraway. Consequently, it is used as a fragrance in cosmetics and as a flavor additive in the food industry. Constituent of Valencia orange essence oil. Flavouring ingredient Carveol is an endogenous metabolite. Carveol is an endogenous metabolite.
cis-Sabinol
(+)-cis-Sabinol belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other. Thus, (+)-cis-sabinol is an isoprenoid lipid molecule. Monoterpenoids are terpenes that contain 10 carbon atoms and are comprised of two isoprene units. The biosynthesis of monoterpenes is known to occur mainly through the methyl-eritritol-phosphate (MEP) pathway in the plastids (PMID: 23746261). Geranyl diphosphate (GPP) is a key intermediate in the biosynthesis of cyclic monoterpenes. GPP undergoes several cyclization reactions to yield a diverse number of cyclic arrangements. (+)-cis-Sabinol is very hydrophobic, practically insoluble in water, and relatively neutral. Artemisia annuaand (https://doi.org/10.1007/s11418-006-0112-9) and in herbal plant Dendranthema indicum (PMID: 29510531). (+)-cis-sabinol, also known as sabinol or sabinol, (1alpha,3alpha,5alpha)-isomer, is a member of the class of compounds known as bicyclic monoterpenoids. Bicyclic monoterpenoids are monoterpenoids containing exactly 2 rings, which are fused to each other. Thus, (+)-cis-sabinol is considered to be an isoprenoid lipid molecule (+)-cis-sabinol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (+)-cis-sabinol can be found in peppermint, which makes (+)-cis-sabinol a potential biomarker for the consumption of this food product.
1,2-Epoxy-p-menth-8-ene
1,2-epoxy-p-menth-8-ene, also known as limonene-1,2-epoxide or 1,2-epoxylimonene, is a member of the class of compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms. 1,2-epoxy-p-menth-8-ene is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 1,2-epoxy-p-menth-8-ene is a green tasting compound found in lemon and wild celery, which makes 1,2-epoxy-p-menth-8-ene a potential biomarker for the consumption of these food products. 1,2-Epoxy-p-menth-8-ene is found in citrus. 1,2-Epoxy-p-menth-8-ene is isolated from oil of Cymbopogon species, orange (Citrus sinensis), Japanese pepper tree (Zanthoxylum piperitum) and other
fenchone
A carbobicyclic compound that is fenchane in which the hydrogens at position 2 are replaced by an oxo group. It is a component of essential oil from fennel (Foeniculum vulgare). Fenchone is a natural organic compound classified as a monoterpene and a ketone. It is a colorless oily liquid. It has a structure and an odor similar to camphor. Fenchone is a constituent of absinthe and the essential oil of fennel. Fenchone is used as a flavor in foods and in perfumery. Only 2 stereoisomers are possible: D-fenchone (enantiomer 1S,4R is dextrogyre (+)) and L-fenchone (enantiomer 1R,4S is levogyre (-)). Due to the small size of the cycle, the 2 other diastereoisomers (1S4S and 1R4R) are not possible. [Wikipedia]. Fenchone is found in many foods, some of which are ceylon cinnamon, sweet basil, saffron, and dill. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1].
(R)-Piperitone
(R)-Piperitone is found in cornmint. (R)-Piperitone is a constituent of Mentha species and Zanthoxylum piperitum (Japanese pepper tree) oil.Piperitone is a natural monoterpene ketone which is a component of some essential oils. Both stereoisomers, the D-form and the L-form, are known. The D-form has a peppermint-like aroma and has been isolated from the oils of plants from the genera Cymbopogon, Andropogon, and Mentha. The L-form has been isolated from Sitka spruce. (Wikipedia) Common constituent of Mentha subspecies oils
D-(+)-dihydrocarvone
(1r,4r)-dihydrocarvone, also known as (2r,5r)-2-methyl-5-isopropenylcyclohexanone, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, (1r,4r)-dihydrocarvone is considered to be an isoprenoid lipid molecule (1r,4r)-dihydrocarvone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (1r,4r)-dihydrocarvone is a herbal and minty tasting compound found in spearmint, which makes (1r,4r)-dihydrocarvone a potential biomarker for the consumption of this food product.
2-Pinen-10-ol
2-Pinen-10-ol is found in citrus. 2-Pinen-10-ol is a flavouring ingredient. 2-Pinen-10-ol is present in mandarin peel oil, raspberry, blackberry, strawberry, ginger, hop oil, black tea, peppermint oil, pepper (Piper nigrum), myrtle leaf or berry, summer savoury (Satureja hortensis) and other foodstuffs (±)-Myrtenol is a flavouring ingredient. It is found in mandarin peel oil, raspberry, blackberry, strawberry, ginger, hop oil, black tea, peppermint oil, pepper (Piper nigrum), myrtle leaf or berry, summer savoury (Satureja hortensis) and other foods.
Pinocarveol
Flavouring ingredient. Pinocarveol is found in many foods, some of which are spearmint, wild celery, hyssop, and sweet bay. Pinocarveol is found in hyssop. Pinocarveol is a flavouring ingredien
(-)-trans-Isopulegone
(-)-trans-Isopulegone is found in fats and oils. (-)-trans-Isopulegone is a flavouring ingredient. It is isolated from oil of American pennyroyal (Hedeoma pulegioides), Mentha species and others, usually with Pulegon Flavouring ingredient. Isolated from oil of American pennyroyal (Hedeoma pulegioides), Mentha subspecies and others, usually with Pulegone. (-)-trans-Isopulegone is found in fats and oils.
beta-Cyclocitral
Constituent of saffron and many other plant materials. Production by Microcystis subspecies A 50:50 mixture with 2,6,6-Trimethyl-2-cyclohexene-1-carboxaldehyde
(+)-Fenchone
(+)-Fenchone is found in fennel. (+)-Fenchone is widespread in plants, e.g. found in fennel (Foeniculum vulgare). (+)-Fenchone is a flavouring ingredient [CCD Widespread in plants, e.g. found in fennel (Foeniculum vulgare). Flavouring ingredient [CCD] (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1].
cis-Citral
Neral, also known as cis-citral or citral b, is a member of the class of compounds known as acyclic monoterpenoids. Acyclic monoterpenoids are monoterpenes that do not contain a cycle. Thus, neral is considered to be an isoprenoid lipid molecule. Neral is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Neral is a sweet, citral, and lemon tasting compound and can be found in a number of food items such as oval-leaf huckleberry, lime, onion-family vegetables, and biscuit, which makes neral a potential biomarker for the consumption of these food products. Neral may refer to: An isomer of Citral Neral, India, a town in Raigad district in the Indian state of Maharashtra Neral railway station A Romulan from Star Trek . cis-Citral, also known as neural or citral B, is the Z-isomer of the terpenoid citral. Citral is found in carrot.
(+)-cis-Carveol
Constituent of dill seed oil (Anethum graveolens). (+)-cis-Carveol is found in dill, caraway, and herbs and spices. (+)-cis-Carveol is found in caraway. (+)-cis-Carveol is a constituent of dill seed oil (Anethum graveolens)
Dihydrocarvone
Dihydrocarvone, also known as menth-8-en-2-one, belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. p-Menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m-menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Monoterpenoids are terpenes that contain 10 carbon atoms and are comprised of two isoprene units. The biosynthesis of monoterpenes in plants is known to occur mainly through the methyl-erythritol-phosphate (MEP) pathway in the plastids (PMID:7640522 ). Dihydrocarvone is an essentially neutral compound. It has a warm herbal, minty taste with a spicy minty woody camphoreous flavour ( Ref:DOI ). Dihydrocarvone is found in highest concentrations in spearmints, caraway, and wild celeries and was detected celery stalks, dills, pepper (spice), and peppermints. This could make dihydrocarvone a potential biomarker for the consumption of these foods. Dihydrocarvone is also found in cannabis plants (PMID:6991645 ). Flavouring agent with spearmint-like flavour. Dihydrocarvone is found in many foods, some of which are dill, peppermint, pepper (spice), and caraway.
(1S,4S)-Dihydrocarvone
Constituent of caraway, dill and mint oils. (1S,4S)-Dihydrocarvone is found in many foods, some of which are herbs and spices, caraway, dill, and mentha (mint). (1S,4S)-Dihydrocarvone is found in caraway. (1S,4S)-Dihydrocarvone is a constituent of caraway, dill and mint oils
(-)-cis-Carveol
(-)-cis-Carveol is found in citrus. (-)-cis-Carveol is a constituent of Valencia orange oil (Citrus sinensis). (-)-cis-Carveol is a flavouring agent Constituent of Valencia orange oil (Citrus sinensis). Flavouring agent. (-)-cis-Carveol is found in citrus.
(+)-3-Thujone
Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. (+)-3-Thujone is found in many foods, some of which are peppermint, common sage, winter savory, and ginger. (+)-3-Thujone is found in common sage. Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. (Wikipedia
(+)-trans-Carveol
(+)-trans-carveol, also known as (1r,5s)-carveol, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes (+)-trans-carveol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (+)-trans-carveol can be found in caraway and dill, which makes (+)-trans-carveol a potential biomarker for the consumption of these food products. (+)-trans-Carveol is a metabolite that is a part of arachidonic acid metabolism, linoleic acid metabolism, retinol metabolism, and serotonergic synapse pathways. It is a substrate for cytochrome P450 2C9 and cytochrome P450 2C19.
cis-Dihydrocarvone
Cis-dihydrocarvone, also known as (2r,5s)-2-methyl-5-isopropenylcyclohexanone or (1r,4s)-menth-8-en-2-one, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, cis-dihydrocarvone is considered to be an isoprenoid lipid molecule. Cis-dihydrocarvone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Cis-dihydrocarvone is a herbal and warm tasting compound and can be found in a number of food items such as dill, spearmint, wild celery, and common oregano, which makes cis-dihydrocarvone a potential biomarker for the consumption of these food products.
(R)-(+)-perillyl alcohol
A perillyl alcohol in which the chiral centre has R configuration.
D-LIMONENE 1,2-EPOXIDE
(1S,4R)-p-Mentha-2,8-dien-1-ol
Isolated from gingergrass (Cymbopogon) and Citrus oils. (1S,4R)-p-Mentha-2,8-dien-1-ol is found in many foods, some of which are sweet bay, spearmint, wild celery, and citrus. (1S,4R)-p-Mentha-2,8-dien-1-ol is found in caraway. (1S,4R)-p-Mentha-2,8-dien-1-ol is isolated from gingergrass (Cymbopogon) and Citrus oil (1S,4R)-p-Mentha-2,8-dien-1-ol is a p-menthane monoterpenoid. cis-Isolimonenol ((1S,4R)-p-Mentha-2,8-dien-1-ol) is a chemical composition of essential oil[1].
Pulegone
Pulegone belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. It is formally classified as a cyclic ketone although it is biochemically a monoterpenoid as it is synthesized via isoprene units. Monoterpenoids are terpenes that contain 10 carbon atoms and are comprised of two isoprene units. The biosynthesis of monoterpenes is known to occur mainly through the methyl-erythritol-phosphate (MEP) pathway in plant cell plastids (PMID:7640522 ). Geranyl diphosphate (GPP) is a key intermediate in the biosynthesis of cyclic monoterpenes. GPP undergoes several cyclization reactions to yield a diverse number of cyclic arrangements. Pulegone is a hydrophobic, neutral compound that is insoluble in water. It exists as a clear, colorless oil. There are two isomers of Pulegone (the R and the S isomer), with the R isomer being more common. It is used industrially as a food additive and a perfuming agent. Pulegone has a fresh, minty or peppermint odor and a minty, fruity or green taste. It is found naturally in the essential oils of a variety of plants such as Nepeta cataria (catnip), Hedeoma pulegioides (pennyroyal), and Mentha species. It is also found in a number of plant foods and spices such as blackberryies, black currants, bell peppers, cornmint, rosemary, black tea, thyme, orange mint, peppermint, and spearmint, which makes it a potential biomarker for the consumption of these food products. Pulegone is also one of more than 140 terpenes that are found in cannabis plants (PMID:6991645 ). Pulegone, also known as (+)-(R)-pulegone or (1r)-(+)-P-menth-4(8)-en-3-one, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, pulegone is considered to be an isoprenoid lipid molecule. Pulegone is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Pulegone can be found in a number of food items such as globe artichoke, sacred lotus, garden onion, and rubus (blackberry, raspberry), which makes pulegone a potential biomarker for the consumption of these food products. Pulegone can be found primarily in saliva. Pulegone is a naturally occurring organic compound obtained from the essential oils of a variety of plants such as Nepeta cataria (catnip), Mentha piperita, and pennyroyal. It is classified as a monoterpene . (+)-pulegone is the (5R)-enantiomer of p-menth-4(8)-en-3-one. Pulegone is a natural product found in Hedeoma multiflora, Clinopodium dalmaticum, and other organisms with data available. See also: Agathosma betulina leaf (part of). The (5R)-enantiomer of p-menth-4(8)-en-3-one. Pulegone, the major chemical constituent of Nepeta catariaessential oil which is an aromatic herb, is one of avian repellents[1]. The molecular target for the repellent action of Pulegone in avian species is nociceptive TRP ankyrin 1 (TRPA1). Pulegone stimulates both TRPM8 and TRPA1 channel in chicken sensory neurons and suppresses the former but not the latter at high concentrations[2]. Pulegone, the major chemical constituent of Nepeta catariaessential oil which is an aromatic herb, is one of avian repellents[1]. The molecular target for the repellent action of Pulegone in avian species is nociceptive TRP ankyrin 1 (TRPA1). Pulegone stimulates both TRPM8 and TRPA1 channel in chicken sensory neurons and suppresses the former but not the latter at high concentrations[2].
Piperitone
Piperitone is found in ceylan cinnamon. Piperitone is a flavouring ingredient.Piperitone is a natural monoterpene ketone which is a component of some essential oils. Both stereoisomers, the D-form and the L-form, are known. The D-form has a peppermint-like aroma and has been isolated from the oils of plants from the genera Cymbopogon, Andropogon, and Mentha. The L-form has been isolated from Sitka spruce. (Wikipedia Piperitone is a p-menthane monoterpenoid that is cyclohex-2-en-1-one substituted by a methyl group at position 3 and an isopropyl group at position 6. It has a role as a volatile oil component and a plant metabolite. It is a p-menthane monoterpenoid and a cyclic terpene ketone. Piperitone is a natural product found in Clinopodium dalmaticum, Eucalyptus fasciculosa, and other organisms with data available. A p-menthane monoterpenoid that is cyclohex-2-en-1-one substituted by a methyl group at position 3 and an isopropyl group at position 6. Flavouring ingredient Piperitone is as a powerful repellent and antiappetent agent. Piperitone is very toxic to Cymbopogon schoenanthus (C. schoenanthus) adults, newly laid eggs and to neonate larvae. Insecticidal activity[1]. Piperitone is as a powerful repellent and antiappetent agent. Piperitone is very toxic to Cymbopogon schoenanthus (C. schoenanthus) adults, newly laid eggs and to neonate larvae. Insecticidal activity[1].
Carveol
Carveol is a clear colorless liquid. Insoluble in water. Carveol is a limonene monoterpenoid that is cyclohex-2-en-1-ol substituted by a methyl group at position 2 and a prop-1-en-2-yl group at position 5. It has a role as a volatile oil component and a plant metabolite. Carveol is a natural product found in Echinophora tournefortii, Trachyspermum anethifolium, and other organisms with data available. Present in oil of grapefruit (Citrus paradisi), mandarin (Citrus reticulata), blackcurrant berries, celery, black tea, dill, caraway seeds and lambs lettuce. Flavouring agent. Carveol is found in many foods, some of which are fruits, parsley, tea, and cumin. Carveol is found in caraway. Carveol is present in oil of grapefruit (Citrus paradisi), mandarin (Citrus reticulata), blackcurrant berries, celery, black tea, dill, caraway seeds and lambs lettuce. Carveol is a flavouring agent A limonene monoterpenoid that is cyclohex-2-en-1-ol substituted by a methyl group at position 2 and a prop-1-en-2-yl group at position 5. Carveol is an endogenous metabolite. Carveol is an endogenous metabolite.
(E,E)-2,4-Decadienal
(2E,4Z)-2,4-Decadienal is a constituent of numerous plants and food sources. Constituent of numerous plants and food sources trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1]. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1].
xi-p-Mentha-3,8-dien-1-ol
xi-p-Mentha-3,8-dien-1-ol is found in herbs and spices. xi-p-Mentha-3,8-dien-1-ol is isolated from black pepper oil. Isolated from black pepper oil. xi-p-Mentha-3,8-dien-1-ol is found in herbs and spices.
(2S,4R)-p-Mentha-1(7),5-dien-2-ol
(2S,4R)-p-Mentha-1(7),5-dien-2-ol is found in herbs and spices. (2S,4R)-p-Mentha-1(7),5-dien-2-ol is a constituent of Piper nigrum (pepper). Constituent of Piper nigrum (pepper). (2S,4R)-p-Mentha-1(7),5-dien-2-ol is found in herbs and spices and pepper (spice).
3,4-Epoxy-p-menth-1(7)-ene
3,4-Epoxy-p-menth-1(7)-ene is found in herbs and spices. 3,4-Epoxy-p-menth-1(7)-ene is isolated from Zanthoxylum piperitum (Japanese pepper tree). Isolated from Zanthoxylum piperitum (Japanese pepper tree). 3,4-Epoxy-p-menth-1(7)-ene is found in herbs and spices.
(S)-Phellandral
(S)-Phellandral is found in herbs and spices. (S)-Phellandral is a constituent of Anethum sowa (Indian dill) Constituent of Anethum sowa (Indian dill). (S)-Phellandral is found in herbs and spices.
xi-3,6-Dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran
Xi-3,6-dihydro-4-methyl-2-(2-methyl-1-propenyl)-2h-pyran is a member of the class of compounds known as pyrans. Pyrans are compounds containing a pyran ring, which is a six-member heterocyclic, non-aromatic ring with five carbon atoms, one oxygen atom and two ring double bonds. Xi-3,6-dihydro-4-methyl-2-(2-methyl-1-propenyl)-2h-pyran is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Xi-3,6-dihydro-4-methyl-2-(2-methyl-1-propenyl)-2h-pyran can be found in alcoholic beverages, citrus, and fruits, which makes xi-3,6-dihydro-4-methyl-2-(2-methyl-1-propenyl)-2h-pyran a potential biomarker for the consumption of these food products. xi-3,6-Dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran is found in alcoholic beverages. xi-3,6-Dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran is present in grapefruit (Citrus paradisi), grapes and other fruit and in wine. xi-3,6-Dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran is a flavouring ingredient.
(R)-p-Mentha-1,8-dien-10-ol
(R)-p-Mentha-1,8-dien-10-ol is a citrus-like flavouring agent [CCD]. Citrus-like flavouring agent [CCD]
(R)-Campholenic aldehyde
(R)-Campholenic aldehyde is found in fruits. (R)-Campholenic aldehyde is a constituent of many essential oils of Juniperus, Eucalyptus and Thymus species. Flavouring ingredient. Found in Juniperus communis (juniper)
(2S,4R)-p-Mentha-1(7),8-dien-2-ol
(2s,4r)-p-mentha-1(7),8-dien-2-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes (2s,4r)-p-mentha-1(7),8-dien-2-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (2s,4r)-p-mentha-1(7),8-dien-2-ol can be found in herbs and spices, which makes (2s,4r)-p-mentha-1(7),8-dien-2-ol a potential biomarker for the consumption of this food product. (2S,4R)-p-Mentha-1(7),8-dien-2-ol is found in herbs and spices. (2S,4R)-p-Mentha-1(7),8-dien-2-ol is isolated from Zanthoxylum piperitum (Japanese pepper tree).
(Z)-2-Methyl-6-methylene-2,7-octadien-1-ol
(Z)-2-Methyl-6-methylene-2,7-octadien-1-ol is found in common thyme. (Z)-2-Methyl-6-methylene-2,7-octadien-1-ol is a constituent of the essential oil of Thymus vulgaris (thyme). Constituent of the essential oil of Thymus vulgaris (thyme). (Z)-2-Methyl-6-methylene-2,7-octadien-1-ol is found in herbs and spices and common thyme.
6,8-Epoxy-p-menth-2-ene
6,8-Epoxy-p-menth-2-ene is found in herbs and spices. 6,8-Epoxy-p-menth-2-ene is isolated from Laurus nobilis (bay laurel). Isolated from Laurus nobilis (bay laurel). 6,8-Epoxy-p-menth-2-ene is found in tea, sweet bay, and herbs and spices.
(R)-Carvotanacetone
(R)-Carvotanacetone is found in fruits. (R)-Carvotanacetone is a constituent of Piper nigrum (pepper) and Cymbopogon nardus (citronella). Also from Tanacetum vulgare (tansy) D000970 - Antineoplastic Agents
cis-2-Thujen-4-ol
trans-2-Thujen-4-ol is found in herbs and spices. trans-2-Thujen-4-ol is a constituent of Laurus nobilis (bay laurel) Constituent of Laurus nobilis (bay laurel). cis-2-Thujen-4-ol is found in tea and herbs and spices.
Dehydrolinalool
(S,E)-3,7-Dimethyl-1,5,7-octatrien-3-ol is found in tea. (S,E)-3,7-Dimethyl-1,5,7-octatrien-3-ol is a constituent of black tea flavour Constituent of black tea flavour. (S,E)-3,7-Dimethyl-1,5,7-octatrien-3-ol is found in tea.
p-Mentha-1(6),8-dien-3-ol
p-Mentha-1(6),8-dien-3-ol is found in fats and oils. p-Mentha-1(6),8-dien-3-ol is isolated from lemongrass oi Isolated from lemongrass oil. p-Mentha-1(6),8-dien-3-ol is found in fats and oils.
4-Acetyl-1,4-dimethyl-1-cyclohexene
4-Acetyl-1,4-dimethyl-1-cyclohexene occurs in juniper oil. 4-Acetyl-1,4-dimethyl-1-cyclohexene is a flavouring ingredient. Occurs in juniper oil. Flavouring ingredient
2,6-Dimethyl-1,7-octadien-3-one
2,6-Dimethyl-1,7-octadien-3-one is found in herbs and spices. 2,6-Dimethyl-1,7-octadien-3-one is a constituent of Tagetes minuta (Mexican marigold)
3-Pinanone
3-Pinanone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive
p-Mentha-1,8-dien-4-ol
Isolated from Japanese pepper tree (Zanthoxylum piperitum), yuzu (Citrus junos), and spearmint (Mentha spicata) oils. p-Mentha-1,8-dien-4-ol is found in many foods, some of which are spearmint, pepper (spice), caraway, and blackcurrant. p-Mentha-1,8-dien-4-ol is found in blackcurrant. p-Mentha-1,8-dien-4-ol is isolated from Japanese pepper tree (Zanthoxylum piperitum), yuzu (Citrus junos), and spearmint (Mentha spicata) oils.
Teresantalol
Teresantalol is a flavouring ingredient. Teresantalol is a constituent of Indian sandalwood oil (Santalum album). Flavouring ingredient. Constituent of Indian sandalwood oil (Santalum album)
Marmelo oxide A
Marmelo oxide B is found in fruits. Marmelo oxide B is a flavour component of quince frui Flavour component of quince fruit. Marmelo oxide A is found in fruits.
(S)-9,10-Cyclo-p-menth-1-en-4-ol
(S)-9,10-Cyclo-p-menth-1-en-4-ol is found in nuts. (S)-9,10-Cyclo-p-menth-1-en-4-ol is a constituent of pistachio (Pistacia vera). Constituent of pistachio (Pistacia vera). (S)-9,10-Cyclo-p-menth-1-en-4-ol is found in nuts and pistachio.
3-Cyclohexene-1-carboxaldehyde, 1,3,4-trimethyl-
3-Cyclohexene-1-carboxaldehyde, 1,3,4-trimethyl- belongs to the family of Cycloalkenes. These are compounds containing a non-aromatic closed ring of carbon atoms in which at least 2 atoms are connected by a double bond
xi-p-Mentha-1(7),2-dien-4-ol
xi-p-Mentha-1(7),2-dien-4-ol is found in herbs and spices. xi-p-Mentha-1(7),2-dien-4-ol is isolated from black pepper oil. Isolated from black pepper oil. xi-p-Mentha-1(7),2-dien-4-ol is found in herbs and spices.
Dehydro-1,8-cineole
Dehydro-1,8-cineole is found in herbs and spices. Dehydro-1,8-cineole is isolated from Laurus nobilis (bay laurel) oi Isolated from Laurus nobilis (bay laurel) oil. Dehydro-1,8-cineole is found in tea, sweet bay, and herbs and spices.
p-Menth-1-en-9-al
P-menth-1-ene-9-al, also known as alpha,4-dimethyl-3-cyclohexene-1-acetaldehyde, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. P-menth-1-ene-9-al is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). P-menth-1-ene-9-al is a herbal and spicy tasting compound found in wild celery, which makes P-menth-1-ene-9-al a potential biomarker for the consumption of this food product. p-Menth-1-en-9-al belongs to the family of Monocyclic Monoterpenes. These are monoterpenes containing 1 ring in the isoprene chain
Terpinolene oxide
Isolated from Zanthoxylum piperitum (Japanese pepper tree). Terpinolene oxide is found in cumin and herbs and spices. Terpinolene oxide is found in cumin. Terpinolene oxide is isolated from Zanthoxylum piperitum (Japanese pepper tree).
p-Menth-3-en-9-al
Constituent of Spanish oregano (Coridothymus capitatus), Origanum subspecies and blackberries. p-Menth-3-en-9-al is found in herbs and spices and fruits. p-Menth-3-en-9-al is found in fruits. p-Menth-3-en-9-al is a constituent of Spanish oregano (Coridothymus capitatus), Origanum species and blackberries
Isocitral
Isocitral is a member of the class of compounds known as acyclic monoterpenoids. Acyclic monoterpenoids are monoterpenes that do not contain a cycle. Isocitral is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Isocitral can be found in herbs and spices and tea, which makes isocitral a potential biomarker for the consumption of these food products. Isocitral is found in herbs and spices. Isocitral is a constituent of Melissa officinalis (lemon balm) and Origanum species
(E)-3,7-Dimethyl-1,5,7-octatrien-3-ol
(E)-3,7-Dimethyl-1,5,7-octatrien-3-ol is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
2-(trans-2-Pentenyl)cyclopentanone
2-(trans-2-Pentenyl)cyclopentanone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
(1R,4R)-p-Mentha-2,8-dien-1-ol
(1R,4R)-p-Mentha-2,8-dien-1-ol is found in caraway. (1R,4R)-p-Mentha-2,8-dien-1-ol is isolated from gingergrass oil (Cymbopogon martini) and various Citrus oils. Metabolic and oxidation produced of Limonene
alpha-Cyclocitral
alpha-Cyclocitral is a 50:50 mixture with 2,6,6-Trimethyl-1-cyclohexene-1-carboxaldehyde
(-)-Isopinocamphone
(-)-Isopinocamphone is found in hyssop. (-)-Isopinocamphone is a constituent of Mentha aquatica (water mint) Constituent of Mentha aquatica (water mint). (-)-Isopinocamphone is found in tea, hyssop, and spearmint.
(R)-p-Mentha-1,8-dien-7-ol
(R)-p-Mentha-1,8-dien-7-ol is found in herbs and spices. (R)-p-Mentha-1,8-dien-7-ol is isolated from caraway seed oi Isolated from caraway seed oil. (R)-p-Mentha-1,8-dien-7-ol is found in herbs and spices.
(-)-3-Thujone
Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. (Wikipedia Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone.
(-)-Pinocamphone
Constituent of the oils of Hyssopus officinalis (hyssop). (-)-Pinocamphone is found in many foods, some of which are herbs and spices, hyssop, spearmint, and roman camomile. (-)-Pinocamphone is found in herbs and spices. (-)-Pinocamphone is a constituent of the oils of Hyssopus officinalis (hyssop)
(-)-trans-Pinocarveol
(-)-trans-Pinocarveol is a constituent of oil of Eucalyptus globulus (Tasmanian blue gum)
Tetrahydro-5-isopropenyl-2-methyl-2-vinylfuran
Tetrahydro-5-isopropenyl-2-methyl-2-vinylfuran is found in alcoholic beverages. Tetrahydro-5-isopropenyl-2-methyl-2-vinylfuran is a flavouring ingredient. Tetrahydro-5-isopropenyl-2-methyl-2-vinylfuran is present in coriander oil, clary sage oil, wine, brandy, coffee and muscat grape juice. Also isolated from passionfruit and sour cherry extracts as artifact from terpene alcohol precursors. Dehydroxylinalool 3,6-oxide is a flavouring ingredient. Present in coriander oil, clary sage oil, wine, brandy, coffee and muscat grape juice. Also isolated from passionfruit and sour cherry extracts as artifact from terpene alcohol precursors.
Photocitral A
Present in photodegraded lemon and orange oiland is) also present in essential oil of Pelargonium citronellum. Epiphotocitral A is found in citrus and herbs and spices. Epiphotocitral A is found in citrus. Epiphotocitral A is present in photodegraded lemon and orange oil. Also present in essential oil of Pelargonium citronellum.
2-Hexylfuran
Reported in roast chicken, roast lamb fat, roast peanut oil, roast guinea hen, fenugreek seed, cooked pork, coriander oil and used cooking fats. 2-Hexylfuran is found in many foods, some of which are fats and oils, animal foods, nuts, and herbs and spices. 2-Hexylfuran is found in animal foods. 2-Hexylfuran is reported in roast chicken, roast lamb fat, roast peanut oil, roast guinea hen, fenugreek seed, cooked pork, coriander oil and used cooking fats.
Anethofuran
Isolated from the leaf oil of Anethum graveolens (dill) [CCD]. Anethofuran is found in dill and herbs and spices. Anethofuran is found in dill. Anethofuran is isolated from the leaf oil of Anethum graveolens (dill).
Isocyclocitral
Isocyclocitral is listed in the EAFUS Food Additive Database (Jan 2001). Listed in the EAFUS Food Additive Database (Jan 2001)
3-Thujanone
3-Thujanone is found in common sage. Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. (Wikipedia). Thujone is a ketone and a monoterpene that occurs naturally in two diastereomeric forms: (-)-alpha-thujone and (+)-beta-thujone. It has a menthol odor. In addition to (-)-alpha-thujone and (+)-beta-thujone, there are their enantiomeric forms, (+)-alpha-thujone and (-)-beta-thujone. 3-Thujanone is found in common sage.
4-(1-Methylethyl)-1-cyclohexene-4-carboxaldehyde
4-(1-Methylethyl)-1-cyclohexene-4-carboxaldehyde belongs to the family of Cycloalkenes. These are compounds containing a non-aromatic closed ring of carbon atoms in which at least 2 atoms are connected by a double bond
Carvotanacetone
Carvotanacetone belongs to the family of Monocyclic Monoterpenes. These are monoterpenes containing 1 ring in the isoprene chain
3,6-Dimethyl-2,3,4,5,8,9-hexahydrobenzofuran
3,6-dimethyl-2,3,4,5,8,9-hexahydrobenzofuran, also known as anethofuran, is a member of the class of compounds known as benzofurans. Benzofurans are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. 3,6-dimethyl-2,3,4,5,8,9-hexahydrobenzofuran is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 3,6-dimethyl-2,3,4,5,8,9-hexahydrobenzofuran can be found in dill, which makes 3,6-dimethyl-2,3,4,5,8,9-hexahydrobenzofuran a potential biomarker for the consumption of this food product. 3,6-dimethyl-2,3,4,5,8,9-hexahydrobenzofuran may be a unique S.cerevisiae (yeast) metabolite.
trans-p-Mentha-1(7),8-dien-2-ol
Trans-p-mentha-1(7),8-dien-2-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Trans-p-mentha-1(7),8-dien-2-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). Trans-p-mentha-1(7),8-dien-2-ol can be found in wild celery, which makes trans-p-mentha-1(7),8-dien-2-ol a potential biomarker for the consumption of this food product.
trans-p-Mentha-2,8-dien-1-ol
Trans-p-mentha-2,8-dien-1-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Trans-p-mentha-2,8-dien-1-ol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Trans-p-mentha-2,8-dien-1-ol is a fresh and minty tasting compound found in spearmint and wild celery, which makes trans-p-mentha-2,8-dien-1-ol a potential biomarker for the consumption of these food products.
(3S),7-Dimethylocta-1,5,7-trien-3-ol
Hotrienol, also known as 3,7-dimethyl-1,5(E),7-octatrien-3-ol, is a member of the class of compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Hotrienol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Hotrienol can be found in tea, which makes hotrienol a potential biomarker for the consumption of this food product. Hotrienol may be a unique S.cerevisiae (yeast) metabolite.
2,8-p-Menthadien-6-ol
2,8-p-menthadien-6-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. 2,8-p-menthadien-6-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 2,8-p-menthadien-6-ol can be found in caraway, which makes 2,8-p-menthadien-6-ol a potential biomarker for the consumption of this food product.
Anthemol
Anthemol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Anthemol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). Anthemol can be found in roman camomile, which makes anthemol a potential biomarker for the consumption of this food product.
cis-Limonene-1,2-oxide
(4r)-limonene 1alpha,2alpha-epoxide, also known as 1beta,2beta-epoxy-4betah-P-menth-8-ene, is a member of the class of compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms (4r)-limonene 1alpha,2alpha-epoxide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (4r)-limonene 1alpha,2alpha-epoxide is a citrus and fresh tasting compound found in lemon and wild celery, which makes (4r)-limonene 1alpha,2alpha-epoxide a potential biomarker for the consumption of these food products. (4r)-limonene 1α,2α-epoxide, also known as 1beta,2beta-epoxy-4betah-P-menth-8-ene, is a member of the class of compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms (4r)-limonene 1α,2α-epoxide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (4r)-limonene 1α,2α-epoxide is a citrus and fresh tasting compound found in lemon and wild celery, which makes (4r)-limonene 1α,2α-epoxide a potential biomarker for the consumption of these food products.
p-Menth-trans-2,8-dien-1-ol
P-mentha-2,8-dien-1-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. P-mentha-2,8-dien-1-ol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). P-mentha-2,8-dien-1-ol can be found in a number of food items such as caraway, pepper (spice), lemon, and wild celery, which makes P-mentha-2,8-dien-1-ol a potential biomarker for the consumption of these food products.
1,8-Menthadien-2-ol
1,8-menthadien-2-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. 1,8-menthadien-2-ol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 1,8-menthadien-2-ol can be found in pepper (spice), which makes 1,8-menthadien-2-ol a potential biomarker for the consumption of this food product.
3,8(9)-p-Menthadien-1-ol
3,8(9)-p-menthadien-1-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. 3,8(9)-p-menthadien-1-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 3,8(9)-p-menthadien-1-ol can be found in pepper (spice), which makes 3,8(9)-p-menthadien-1-ol a potential biomarker for the consumption of this food product.
cis-2,8-Menthadien-2-ol
Cis-2,8-menthadien-2-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Cis-2,8-menthadien-2-ol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cis-2,8-menthadien-2-ol can be found in pepper (spice), which makes cis-2,8-menthadien-2-ol a potential biomarker for the consumption of this food product.
p-Mentha-1,5-dien-7-ol
P-mentha-1,5-dien-7-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. P-mentha-1,5-dien-7-ol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). P-mentha-1,5-dien-7-ol can be found in ginger, which makes P-mentha-1,5-dien-7-ol a potential biomarker for the consumption of this food product.
D-Camphor
(+)-camphor, also known as formosa camphor or 2-bornanone, is a member of the class of compounds known as bicyclic monoterpenoids. Bicyclic monoterpenoids are monoterpenoids containing exactly 2 rings, which are fused to each other. Thus, (+)-camphor is considered to be an isoprenoid lipid molecule (+)-camphor is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (+)-camphor is a bitter, camphor, and herbal tasting compound and can be found in a number of food items such as sugar apple, sunflower, fennel, and cardamom, which makes (+)-camphor a potential biomarker for the consumption of these food products. C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D000890 - Anti-Infective Agents Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2]. Camphor ((±)-Camphor) is a topical anti-infective and anti-pruritic and internally as a stimulant and carminative. However, Camphor is poisonous when ingested. Antiviral, antitussive, and anticancer activities[1]. Camphor is a TRPV3 agonist[2].
(+/-)-cis- and trans-1,2-Dihydroperillaldehyde
It is used as a food additive .
Artemisia ketone
Artemisia ketone is a member of the class of compounds known as enones. Enones are compounds containing the enone functional group, with the structure RC(=O)CR. Artemisia ketone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Artemisia ketone is a berry, green, and herbal tasting compound found in sunflower and tarragon, which makes artemisia ketone a potential biomarker for the consumption of these food products.
Dill ether
This is the natural occuring form of dill ether [FooDB]
Perillyl alcohol
Perillyl alcohol is a limonene monoterpenoid consists of a cyclohexene ring substituted by a hydroxymethyl and a prop-1-en-2-yl group at positions 1 and 4 respectively. It is a constituent of a variety of essential oils including lavender. It has a role as a plant metabolite and a volatile oil component. Perillyl alcohol is a natural product found in Trachyspermum anethifolium, Geum heterocarpum, and other organisms with data available. Perillyl Alcohol is a naturally occurring monoterpene related to limonene with antineoplastic activity. Perillyl alcohol inhibits farnesyl transferase and geranylgeranyl transferase, thereby preventing post-translational protein farnesylation and isoprenylation and activation of oncoproteins such as p21-ras, and arresting tumor cells in the G1 phase of the cell cycle. (NCI04) Perillyl alcohol is a monoterpene isolated from the essential oils of lavendin, peppermint, spearmint, cherries, celery seeds, and several other plants. In animal studies it has been shown to regress pancreatic, mammary, and liver tumors, to exhibit possible application as a chemopreventative agent for colon, skin, and lung cancer, and as a chemotherapeutic agent for neuroblastoma, and prostate and colon cancer.(PMID: 9855569) [HMDB]. p-Mentha-1,8-dien-7-ol is found in many foods, some of which are caraway, ginger, german camomile, and sweet bay. Perillyl alcohol is a monoterpene isolated from the essential oils of lavendin, peppermint, spearmint, cherries, celery seeds, and several other plants. In animal studies it has been shown to regress pancreatic, mammary, and liver tumors, to exhibit possible application as a chemopreventative agent for colon, skin, and lung cancer, and as a chemotherapeutic agent for neuroblastoma, and prostate and colon cancer.(PMID:9855569). A limonene monoterpenoid consists of a cyclohexene ring substituted by a hydroxymethyl and a prop-1-en-2-yl group at positions 1 and 4 respectively. It is a constituent of a variety of essential oils including lavender. C471 - Enzyme Inhibitor > C2020 - Farnesyl Transferase Inhibitor D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1]. (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1]. Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1]. Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1].
(1alpha,5alpha,6alpha)-2,6-dimethylbicyclo[3.1.1]hept-2-ene-6-methanol
(-)-3-Isothujone
α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3].
trans-Dihydrocarvone
(1r,4r)-dihydrocarvone, also known as (2r,5r)-2-methyl-5-isopropenylcyclohexanone, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, (1r,4r)-dihydrocarvone is considered to be an isoprenoid lipid molecule (1r,4r)-dihydrocarvone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (1r,4r)-dihydrocarvone is a herbal and minty tasting compound found in spearmint, which makes (1r,4r)-dihydrocarvone a potential biomarker for the consumption of this food product.
Dihydrocarvone
A dihydrocarvone in (R,R) configuration. A dihydrocarvone resulting from reduction of the endocyclic cyclohexene double bond.
(+/-)-cis- and trans-1,2-Dihydroperillaldehyde
It is used as a food additive .
Thujone
α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3]. α-Thujone is a monoterpene isolated from Thuja occidentalis essential oil with potent anti-tumor activities. α-Thujone is a reversible modulator of the GABA type A receptor and the IC50 for α-Thujone is 21 μM in suppressing the GABA-induced currents. α-Thujone induces ROS accumulation-dependent cytotoxicity, also induces cell apoptosis and autophagy. α-Thujone has antinociceptive, insecticidal, and anthelmintic activity, and easily penetrates the blood-brain barrier[1][2][3].
(Z)-7-methoxy-3-methylene-octa-1,6-diene|2-Methyl-6-methylen-octadien-2,7-ol
Fenchon
(1R,4S)-fenchone is a fenchone that has (1R,4S)-stereochemistry. It is a constituent of the essential oils obtained from fennel. It has a role as a plant metabolite. It is an enantiomer of a (1S,4R)-fenchone. (-)-Fenchone is a natural product found in Thuja occidentalis and Magnolia officinalis with data available. A fenchone that has (1R,4S)-stereochemistry. It is a constituent of the essential oils obtained from fennel. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1].
Citral
An enal that consists of octa-2,6-dienal bearing methyl substituents at positions 3 and 7. A mixture of the two geometric isomers geranial and neral, it is the major constituent (75-85\\\\%) of oil of lemon grass, the volatile oil of Cymbopogon citratus, or of C. flexuosus. It also occurs in oils of verbena, lemon, and orange. Citral is a monoterpene found in Cymbopogon citratus essential oil, with antihyperalgesic, anti-nociceptive and anti-inflammatory effects[1]. Citral is a monoterpene found in Cymbopogon citratus essential oil, with antihyperalgesic, anti-nociceptive and anti-inflammatory effects[1].
(E,E)-2,4-Decadienal
(2E,4E)-deca-2,4-dienal is a polyunsaturated fatty aldehyde that is decanal which has undergone formal dehydrogenation to introduce trans- double bonds at the 2-3 and 4-5 positions. A product of lipid peroxidation in cell membranes and a component of cooking oil fumes. It has a role as a nematicide and an apoptosis inducer. 2,4-Decadienal is a natural product found in Vaccinium vitis-idaea, Streptomyces, and other organisms with data available. trans,trans-2,4-decadienal is a metabolite found in or produced by Saccharomyces cerevisiae. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1]. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1].
D-FENCHONE
(1S,4R)-fenchone is a fenchone that has 1S,4R stereochemistry. A colourless, oily liquid found in fennel oil, it is used in perfumery and as flavour in foods. It is an enantiomer of a (1R,4S)-fenchone. (+)-Fenchone is a natural product found in Catha edulis, Cinnamomum camphora, and other organisms with data available.
Perillyl alcohol
Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1]. Perillyl alcohol, a monoterpene,?is active in inducing apoptosis in tumor cells without affecting normal cells[1].
Decadienealdehyde
trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1]. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1].
beta-thujone
(-)-beta-thujone
2,4-Decadienal
(2e,4z)-decadienal is a member of the class of compounds known as medium-chain aldehydes. Medium-chain aldehydes are an aldehyde with a chain length containing between 6 and 12 carbon atoms. Thus, (2e,4z)-decadienal is considered to be a fatty aldehyde lipid molecule (2e,4z)-decadienal is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (2e,4z)-decadienal has a fat, fatty, and fried taste.
Piperitone
Piperitone is as a powerful repellent and antiappetent agent. Piperitone is very toxic to Cymbopogon schoenanthus (C. schoenanthus) adults, newly laid eggs and to neonate larvae. Insecticidal activity[1]. Piperitone is as a powerful repellent and antiappetent agent. Piperitone is very toxic to Cymbopogon schoenanthus (C. schoenanthus) adults, newly laid eggs and to neonate larvae. Insecticidal activity[1].
cis-Isolimonenol
cis-Isolimonenol ((1S,4R)-p-Mentha-2,8-dien-1-ol) is a chemical composition of essential oil[1].
xi-3,6-Dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran
2-hexylfuran
A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a hexyl group.
β-Cyclocitral
A monoterpenoid formally derived from citral by cyclisation. It is a volatile compound produced by a cyanobacteria.
1H-Indene-2-methanol,2,3,3a,4,7,7a-hexahydro-,(cis)-(9CI)
()-(1α,2β,5α)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, (1S)-
Bicyclo[4.1.0]hept-4-en-3-ol, 3,7,7-trimethyl- [1S-(1-alpha,3-alpha, 6-alpha)]-
4,7-Methano-1H-inden-5-ol, octahydro-, (3aR,4R,5S,7R,7aR)-
[1R-(1alpha,2beta,4beta,6alpha)]-2,2,7-trimethyl-3-oxatricyclo[4.1.1.02,4]octane
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans-
(+)-trans-Pinocarveol
(-)-trans-pinocarveol, also known as (-)-trans-2(10)-pinen-3-ol or (1s,3r,5s)-(-)-2(10)-pinen-3-ol, is a member of the class of compounds known as bicyclic monoterpenoids. Bicyclic monoterpenoids are monoterpenoids containing exactly 2 rings, which are fused to each other (-)-trans-pinocarveol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (-)-trans-pinocarveol can be found in a number of food items such as cumin, sweet bay, pepper (spice), and common sage, which makes (-)-trans-pinocarveol a potential biomarker for the consumption of these food products.
Cyclohexanol, 2-methylene-5-(1-methylethenyl)-, (1S-cis)-
trans-5-Isopropenyl-2-methyl-2-vinyltetrahydrofuran
30465_FLUKA
trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1]. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1].
cis-2-Carveol
(-)-cis-carveol, also known as cis-P-mentha-6,8-dien-2-ol, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, (-)-cis-carveol is considered to be an isoprenoid lipid molecule (-)-cis-carveol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (-)-cis-carveol is a spearmint tasting compound found in citrus, which makes (-)-cis-carveol a potential biomarker for the consumption of this food product.
D-CAMPHOR
(+)-camphor, also known as formosa camphor or 2-bornanone, is a member of the class of compounds known as bicyclic monoterpenoids. Bicyclic monoterpenoids are monoterpenoids containing exactly 2 rings, which are fused to each other. Thus, (+)-camphor is considered to be an isoprenoid lipid molecule (+)-camphor is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (+)-camphor is a bitter, camphor, and herbal tasting compound and can be found in a number of food items such as sugar apple, sunflower, fennel, and cardamom, which makes (+)-camphor a potential biomarker for the consumption of these food products. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative. (+)-Camphor is a food additive used medicinally as a preservative.
(-)-Fenchone
Isolated from various essential oils e.g. Thuja occidentalis and Artemisia frigida. Flavouring ingredient [CCD] (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1]. (-)-Fenchone, a bicyclic monoterpene, is widely distributed in plants and found in essential oils from Foeniculum vulgare. (-)-Fenchone is oxidized to 6-endo-hydroxyfenchone, 6-exo-hydroxyfenchone and 10-hydroxyfenchone derivatives by CYP2A6 and CYP2B6 in human liver microsomes with CYP2A6 playing a more important role than CYP2B6[1].
(+)-limonene oxide
Isolated from oil of Cymbopogon subspecies, orange (Citrus sinensis), Japanese pepper tree (Zanthoxylum piperitum) and others. 1,2-Epoxy-p-menth-8-ene is found in spearmint, citrus, and herbs and spices.
(+)-dihydrocarvone
(1r,4r)-dihydrocarvone, also known as (2r,5r)-2-methyl-5-isopropenylcyclohexanone, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Thus, (1r,4r)-dihydrocarvone is considered to be an isoprenoid lipid molecule (1r,4r)-dihydrocarvone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (1r,4r)-dihydrocarvone is a herbal and minty tasting compound found in spearmint, which makes (1r,4r)-dihydrocarvone a potential biomarker for the consumption of this food product.
(S)-(?)-Perillyl alcohol
Occurs in a variety of essential oils, e.g. lavender (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1]. (S)-(?)-Perillyl alcohol is a monoterpene found in lavender, inhibits farnesylation of Ras, upregulates the mannose-6-phosphate receptor and induces apoptosis. Anti-cancer activity[1].
laevo-pinocarveol
Constituent of oil of Eucalyptus globulus (Tasmanian blue gum)
(2E,4E)-Decadienal
Present in apple, bitter orange peel oil, mandarin peel oil, wheat bread, cooked beef, raw cured pork, cooked scented rice, quince, maize, dried bonito, clary sage (Salvia sclarea), water yam (Dioscerea alata) melon and peas. Flavouring agent. (2E,4E)-Decadienal is found in many foods, some of which are cereals and cereal products, herbs and spices, animal foods, and pomes. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1]. trans,trans-2,4-Decadienal is a lipid peroxidation product of linolieic acid[1].
α-campholenaldehyde
Constituent of many essential oils of Juniperus, Eucalyptus and Thymus subspecies (R)-Campholenic aldehyde is found in sunflower and fruits.
(-)-DIHYDROCARVONE
A dihydrocarvone in (S,S) configuration. The (1S,4R)-stereoisomer of dihydrocarvone.
(5R)-5-isopropyl-2-methyl-2-cyclohexen-1-one
A dihydrocarvone compound having the exocyclic isopropenyl double bond reduced and (R)-configuration.
(4R)-ipsdienol
A meroterpenoid that is (4R)-octa-2,7-dien-4-ol substituted at positions 2 and 6 by methyl and methylidene groups respectively.
Pinocarveol
A pinane monoterpenoid that is a bicyclo[3.1.1]heptane substituted by two methyl groups at position 6, a methylidene group at position 2 and a hydroxy group at position 3.
Nerol oxide
A member of the class of pyrans that is 3,6-dihydro-2H-pyran which is substituted at positions 2 and 4 by a 2-methylprop-1-en-1-yl group and a methyl group, respectively.
(1R,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-en-1-ol
(3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol
1-p-menth-1-ene-9-al
A monoterpenoid that is propanal substituted by a 4-methylcyclohex-3-en-1-yl group at position 2.
Limonene 1,2-epoxide
An epoxide resulting from the formal epoxidation of the cyclic double bond of limonene.
alpha-campholenaldehyde
An aldehyde that is acetaldehyde in which one of the methyl hydrogens is substituted by a 2,2,3-trimethylcyclopent-3-en-1-yl group. It is a constituent of the essential oil extracted from Angasomyrtus salina.
(1S,4R)-fenchone
A fenchone that has 1S,4R stereochemistry. A colourless, oily liquid found in fennel oil, it is used in perfumery and as flavour in foods.
(S)-(-)-Perillyl alcohol
A perillyl alcohol in which the chiral centre has S configuration.
(1s,5r,6s)-2,7,7-trimethylbicyclo[3.1.1]hept-2-en-6-ol
2-[(1s)-2,2,3-trimethylcyclopent-3-en-1-yl]acetaldehyde
(1s,5r)-2-methylidene-5-(prop-1-en-2-yl)cyclohexan-1-ol
(2s)-3-methyl-2-(3-methylbut-2-en-1-yl)-2,5-dihydrofuran
(1s,2r,4s)-5,5-dimethyl-6-methylidenebicyclo[2.2.1]heptan-2-ol
(1s,3s,5r)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptan-3-ol
(1s)-3-methyl-1-(prop-1-en-2-yl)cyclohex-3-en-1-ol
(2r,3e)-5-methyl-2-(prop-1-en-2-yl)hexa-3,5-dien-1-ol
1,3,4-trimethyl-3-cyclohexene carbox-aldehyde
{"Ingredient_id": "HBIN001035","Ingredient_name": "1,3,4-trimethyl-3-cyclohexene carbox-aldehyde","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1=C(CC(CC1)(C)C=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "43035","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-(4-methylenecyclohexyl)ethenol
{"Ingredient_id": "HBIN001527","Ingredient_name": "1-(4-methylenecyclohexyl)ethenol","Alias": "1-(4-methylidenecyclohexyl)ethenol; 1(7),8(10)-p-Menthadien-9-ol","Ingredient_formula": "C10H16O","Ingredient_Smile": "C=C1CCC(CC1)C(=C)CO","Ingredient_weight": "152.23 g/mol","OB_score": "61.5446066","CAS_id": "NA","SymMap_id": "SMIT05008","TCMID_id": "NA","TCMSP_id": "MOL002833","TCM_ID_id": "NA","PubChem_id": "34627","DrugBank_id": "NA"}
15-dien-4β-ol
{"Ingredient_id": "HBIN001656","Ingredient_name": "15-dien-4\u03b2-ol","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(=C)C1CCC(=C)C(C1)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34011","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1(7),2-p-Menthadien-6-ol
{"Ingredient_id": "HBIN001970","Ingredient_name": "1(7),2-p-Menthadien-6-ol","Alias": "3-Cyclohexen-1-ol, 2-methylene-5-(1-methylethyl)-, trans-; 1(7),2-p-menthadien-6-ol; 3-Cyclohexen-1-ol, 2-methylene-5-(1-methylethyl)-, (1S-trans)- (9CI); 95259-30-6; 114179-04-3; (1S,5R)-5-ISOPROPYL-2-METHYLIDENECYCLOHEX-3-EN-1-OL; VKAGFXRPRUAOHV-ZJUUUORDSA-N; CTK3F4020","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(C)C1CC(C(=C)C=C1)O","Ingredient_weight": "152.23","OB_score": "41.49731524","CAS_id": "30681-15-3","SymMap_id": "SMIT01119","TCMID_id": "13717","TCMSP_id": "MOL002828","TCM_ID_id": "NA","PubChem_id": "11446451","DrugBank_id": "NA"}
1, 7, 7-Trimethylbicyclo[2.2.1]hept-5-en-2-ol
{"Ingredient_id": "HBIN001973","Ingredient_name": "1, 7, 7-Trimethylbicyclo[2.2.1]hept-5-en-2-ol","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1(C2CC(C1(C=C2)C)O)C","Ingredient_weight": "152.23 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40840","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "572663","DrugBank_id": "NA"}
1,7,7-Trimethyl-bicyclo-heptan-2-one
{"Ingredient_id": "HBIN001975","Ingredient_name": "1,7,7-Trimethyl-bicyclo-heptan-2-one","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1(C2CCC1(C(=O)C2)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42008","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1(7),8(10)-p-menthadien-9-ol
{"Ingredient_id": "HBIN001978","Ingredient_name": "1(7),8(10)-p-menthadien-9-ol","Alias": "1-(4-methylidenecyclohexyl)ethenol; AC1NSXYP","Ingredient_formula": "C10H16O","Ingredient_Smile": "C=C1CCC(CC1)C(=C)CO","Ingredient_weight": "152.23 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT16457","TCMID_id": "13718","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "34627","DrugBank_id": "NA"}
(1R,2R,5S)-2,6,6-trimethylnorpinan-3-one
{"Ingredient_id": "HBIN003059","Ingredient_name": "(1R,2R,5S)-2,6,6-trimethylnorpinan-3-one","Alias": "(1R,2R,5S)-2,6,6-trimethyl-3-norpinanone; (1R,2R,5S)-2,7,7-trimethylbicyclo[3.1.1]heptan-3-one","Ingredient_formula": "C10H16O","Ingredient_Smile": "NA","Ingredient_weight": "152.23","OB_score": "49.953969","CAS_id": "18358-53-7","SymMap_id": "SMIT08783","TCMID_id": "NA","TCMSP_id": "MOL007322","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,6-Dimethyl-3,5,7-octatriene-2-ol, ,E,E-
{"Ingredient_id": "HBIN004916","Ingredient_name": "2,6-Dimethyl-3,5,7-octatriene-2-ol, ,E,E-","Alias": "(3E,5E)-2,6-dimethylocta-3,5,7-trien-2-ol","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(=CC=CC(C)(C)O)C=C","Ingredient_weight": "152.23 g/mol","OB_score": "21.42989287","CAS_id": "NA","SymMap_id": "SMIT09631","TCMID_id": "NA","TCMSP_id": "MOL008324","TCM_ID_id": "NA","PubChem_id": "5363695","DrugBank_id": "NA"}
(2E,4E)-deca-2.4-dienal
{"Ingredient_id": "HBIN005560","Ingredient_name": "(2E,4E)-deca-2.4-dienal","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CCCCCC=CC=CC=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42917","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-isopropenyl-5-methylhexa-trans-3,5-dien-1-ol
{"Ingredient_id": "HBIN005845","Ingredient_name": "2-isopropenyl-5-methylhexa-trans-3,5-dien-1-ol","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(=C)C=CC(CO)C(=C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "11612","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-isopropyl-3-methyl-1-cyclohex-2-enone
{"Ingredient_id": "HBIN005852","Ingredient_name": "2-isopropyl-3-methyl-1-cyclohex-2-enone","Alias": "3-methyl-2-propan-2-yl-cyclohex-2-en-1-one; 2-isopropyl-3-methyl-cyclohex-2-en-1-one; 3-methyl-2-propan-2-ylcyclohex-2-en-1-one","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1=C(C(=O)CCC1)C(C)C","Ingredient_weight": "152.23 g/mol","OB_score": "63.8748657","CAS_id": "NA","SymMap_id": "SMIT11958","TCMID_id": "NA","TCMSP_id": "MOL010999","TCM_ID_id": "NA","PubChem_id": "10103344","DrugBank_id": "NA"}
(2S,4R)-p-mentha-［1(7),8]-diene-2-hydroperoxide
{"Ingredient_id": "HBIN006746","Ingredient_name": "(2S,4R)-p-mentha-\uff3b1(7),8]-diene-2-hydroperoxide","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(=C)C1CCC(=C)C(C1)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41629","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,6,6-trimethylnorpinan-2-one
{"Ingredient_id": "HBIN007694","Ingredient_name": "3,6,6-trimethylnorpinan-2-one","Alias": "NA","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1CC2CC(C1=O)C2(C)C","Ingredient_weight": "152.23 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT18045","TCMID_id": "21954","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "85945","DrugBank_id": "NA"}
α- citral
{"Ingredient_id": "HBIN015455","Ingredient_name": "\u03b1- citral","Alias": "\u03b1-Citral","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC(=CCCC(=CC=O)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39856;39185","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
β-Pinene oxide
{"Ingredient_id": "HBIN018244","Ingredient_name": "\u03b2-Pinene oxide","Alias": "\u03b2-pineneoxide","Ingredient_formula": "C10H16O","Ingredient_Smile": "CC1(C2CCC3(C1C2)CO3)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36570;40242","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
