Chemical Formula: C12H16O3
Chemical Formula C12H16O3
Found 315 metabolite its formula value is C12H16O3
trans-Isoasarone
Alpha-asarone is the trans-isomer of asarone. It has a role as an anticonvulsant and a GABA modulator. alpha-Asarone is a natural product found in Sphallerocarpus gracilis, Asarum hypogynum, and other organisms with data available. trans-Isoasarone is found in carrot. trans-Isoasarone is a constituent of Asarum species and carrot seed (Daucus carota) (CCD) Constituent of Asarum subspecies and carrot seed (Daucus carota) (CCD). trans-Isoasarone is found in wild carrot and carrot. D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D009676 - Noxae > D002273 - Carcinogens D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents The trans-isomer of asarone. alpha-Asarone (α-Asarone) is one of the main psychoactive compounds, and possesses an antidepressant-like activity in mice. alpha-Asarone (α-Asarone) is one of the main psychoactive compounds, and possesses an antidepressant-like activity in mice. alpha-Asarone (α-Asarone) is one of the main psychoactive compounds, and possesses an antidepressant-like activity in mice. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1]. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1].
gamma-Asarone
2,4,5-Trimethoxy-1-allylbenzene is a benzenetriol. gamma-Asarone is a natural product found in Blumea mollis, Asarum yakusimense, and other organisms with data available. gamma-Asarone is found in herbs and spices. gamma-Asarone is a constituent of Acorus calamus (sweet flag) D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D009676 - Noxae > D002273 - Carcinogens D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents
Primin
Primin is a 1,4-benzoquinone having a methoxy substituent at the 2-position and a pentyl substituent at the 6-position. It has a role as a hapten, a metabolite, an antimicrobial agent, an antifeedant and an allergen. Primin is a natural product found in Miconia eriodonta, Cophinforma mamane, and other organisms with data available. See also: Primula veris flower (part of). A 1,4-benzoquinone having a methoxy substituent at the 2-position and a pentyl substituent at the 6-position. Primin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=15121-94-5 (retrieved 2024-06-29) (CAS RN: 15121-94-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
trans-Isoasarone
Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1]. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1].
Elemicin
Elemicin is an olefinic compound. Elemicin is a natural product found in Anemopsis californica, Asarum celsum, and other organisms with data available. Constituent of Elemi oil and Myristica fragrans (nutmeg). Elemicin is found in many foods, some of which are nutmeg, carrot, parsley, and tarragon. Elemicin is found in carrot. Elemicin is a constituent of Elemi oil and Myristica fragrans (nutmeg). Elemicin is an orally active alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin has anti-influenza activities, antimicrobial, antioxidant, and antiviral activities. Elemicin and its reactive metabolite of 1′-Hydroxyelemicin can induce hepatotoxicity[1][2][3][4]. Elemicin is a alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin is one of the main components in aromatic food and has antimicrobial, antioxidant, and antiviral activities. Elemicin possesses genotoxicity and carcinogenicity[1]. Elemicin is a alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin is one of the main components in aromatic food and has antimicrobial, antioxidant, and antiviral activities. Elemicin possesses genotoxicity and carcinogenicity[1].
Isoelemicin
Isoelemicin is found in herbs and spices. Isoelemicin is a constituent of oil of nutmeg Constituent of oil of nutmeg. Isoelemicin is found in ucuhuba and herbs and spices.
3,4-Dihydro-6-methoxy-3,7-dimethyl-1H-2-benzopyran-8-ol
3,4-Dihydro-6-methoxy-3,7-dimethyl-1H-2-benzopyran-8-ol is a mycotoxin produced by Penicillium corylophilum and Penicillium steckii. It is isolated from P. steckii infected millet hay. Mycotoxin production by Penicillium corylophilum and Penicillium steckii. Isolated from P. steckii infected millet hay
Jasmine ketolactone
Jasmine ketolactone is found in herbs and spices. Jasmine ketolactone is a constituent of Italian jasmine oil (Jasminum grandiflorum)
(Z)-3-Oxo-2-(2-pentenyl)-1-cyclopenteneacetic acid
(Z)-3-Oxo-2-(2-pentenyl)-1-cyclopenteneacetic acid is found in pulses. (Z)-3-Oxo-2-(2-pentenyl)-1-cyclopenteneacetic acid is a constituent of Vicia faba
3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol
3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol is found in mushrooms. 3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol is isolated from mushroom Lentinus crinitus. Isolated from mushroom Lentinus crinitus. 3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol is found in mushrooms.
5-Deoxydiplosporin
5-Deoxydiplosporin is a mycotoxin produced by Diplodia macrospora isolated from infected maiz
4-Methoxybenzyl butanoate
4-Methoxybenzyl butanoate is a flavouring agent Flavouring agent
Amyl salicylate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates Amyl salicylate is a flavouring agent. Flavouring agent
2-Phenoxyethyl isobutyrate
2-Phenoxyethyl isobutyrate is a flavouring ingredient. Flavouring ingredient
Isoamyl salicylate
Isoamyl salicylate is found in alcoholic beverages. Isoamyl salicylate is isolated from fruit aromas. Also present in rum and black tea. Isoamyl salicylate is a flavouring agent. Isolated from fruit aromasand is) also present in rum and black tea. Flavouring agent. Isoamyl salicylate is found in tea, alcoholic beverages, and fruits. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
1,2,4-Trimethoxy-5-propenylbenzene
Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1]. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1].
(+)-8-Acetoxycarvone
(+)-8-acetoxycarvone 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 (+)-8-acetoxycarvone is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). (+)-8-acetoxycarvone can be found in cornmint, which makes (+)-8-acetoxycarvone a potential biomarker for the consumption of this food product.
asarone
A phenylpropanoid that is benzene substituted by methoxy groups at positions 1, 2 and 4 and a propen-1-yl group at position 5. It has been isolated from Acorus. Asarone is a phenylpropanoid that is benzene substituted by methoxy groups at positions 1, 2 and 4 and a propen-1-yl group at position 5. It has been isolated from Acorus. It has a role as a plant metabolite. It is a phenylpropanoid, a member of methoxybenzenes and an alkenylbenzene. beta-Asarone is a natural product found in Asarum hypogynum, Carpesium abrotanoides, and other organisms with data available. See also: Acorus calamus root (part of). D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D009676 - Noxae > D002273 - Carcinogens D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents The cis-isomer of asarone. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1]. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1].
1,3-Cyclopentanedione, 2-(dihydro-5-propyl-2(3H)-furanylidene)-
3-hydroxy-2,2-dimethyl-3-(4-methylphenyl)propanoic acid
3-(Hydroxymethyl)-1-(3-methylbut-2-enyl)-6-oxabicyclo[3.2.0]hept-2-en-7-one
2-sec-Butyl-4,6-dihydroxy-3-methyl-benzaldehyd|2-sec-butyl-4,6-dihydroxy-3-methyl-benzaldehyde
4beta-hydroxy-11,12,13-trinor-5-eudesmen-1,7-dione
(S)-3-(3,5-dihydroxy-2,4-dimethylphenyl)-butan-2-one
(1Z,3E,5R,6R)-5,6-Dihydro-6-(5-hydroxy-1,3-heptadienyl)-2H-pyran-2-one|(6R,5R)-6-<(1Z,3E)-5-hydroxy-1,3-heptadienyl>-5,6-dihydro-2H-pyran-2-one
(E)-4-methoxy-3-methyl-6-(pent-2-en-2-yl)-2H-pyran-2-one|aplysiopsene A
(3R)-3r,4t,5-Trimethyl-isochroman-6,8-diol|decarboxydihydrocitrinin
(E)-2-(hydroxymethyl)-3-(2-hydroxypent-3-enyl)phenol
(S,E)-3-ethyl-6-(4-hydroxypent-2-en-2-yl)-2H-pyran-2-one|nocapyrone G
(3aR,6aS)-5,6-dimethyl-6a-propyl-3a,6a-dihydro-2H-cyclopenta[b]furan-2,4(3H)-dione|suberosanone A
(2,4-dihydroxy-6-methylphenyl) (2-methylpropyl) ketone
1alpha,2alpha,4alpha-4-ethoxy-1,2,3,4-tetrahydronaphthalene-1,2-diol
(4aS,5S,8R)-5,6,7,8-tetrahydro-3,8-dihydroxy-4a,5-dimethylnaphthalen-2(4aH)-one
1-Cyclohexene-1-acrylic acid, 2,6,6-trimethyl-3-oxo-
(Z)-3-Oxo-2-(2-pentenyl)-1-cyclopenteneacetic acid
Amyl salicylate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Trefol
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Ethyl 3-(bicyclo[2.2.1]hept-5-en-2-yl)-3-oxopropanoate
2-(3-Methoxy-phenyl)-2-Methyl-propionic acid Methyl ester
(2S,5R)-N-BOC-5-METHYLPYRROLIDINE-2-CARBOXYLICACID
2-(4-(2-hydroxyethyl)phenyl)-2-methylpropanoic acid
(S)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONICACID
(2S-CIS)-3-(ACETYLOXY)-2,3-DIHYDRO-2-(4-METHOXY-PHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE
3-(4-HYDROXYMETHYL-PHENYL)-PROPIONIC ACID ETHYL ESTER
2-(2-Hydroxyethyl)-2-methyl-3,4-dihydro-2H-1-benzopyran-6-ol
3,4-Dihydro-5-hydroxy-2-methyl-2H-1-benzopyran-2-ethanol
Elemicin
Elemicin is an orally active alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin has anti-influenza activities, antimicrobial, antioxidant, and antiviral activities. Elemicin and its reactive metabolite of 1′-Hydroxyelemicin can induce hepatotoxicity[1][2][3][4]. Elemicin is a alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin is one of the main components in aromatic food and has antimicrobial, antioxidant, and antiviral activities. Elemicin possesses genotoxicity and carcinogenicity[1]. Elemicin is a alkenylbenzene widely distributed in many herbs and spices. Elemicin inhibits Stearoyl-CoA Desaturase 1 (SCD1) by metabolic activation. Elemicin is one of the main components in aromatic food and has antimicrobial, antioxidant, and antiviral activities. Elemicin possesses genotoxicity and carcinogenicity[1].
Asaron
D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D009676 - Noxae > D002273 - Carcinogens D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1]. Beta-asarone is a major ingredient of Acorus tatarinowii Schott, penetrates blood brain barrier, with the properties of immunosuppression, central nervous system inhibition, sedation, and hypothermy. Beta-asarone protects against Parkinson’s disease[1].
5353-15-1
D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D009676 - Noxae > D002273 - Carcinogens D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents
(E)-2-(Hydroxymethyl)-3-(4-hydroxypent-1-enyl)phenol
A natural product found in Pestalotiopsis virgatula.
isoamyl salicylate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol
Ethyl-p-methoxyhydrocinnamate
Ethyl-p-methoxyhydrocinnamate is a phenolic compound that can be isolated from the edible rhizomes of Erythrina variegate[1].
1-[(2r,5s)-5-(furan-3-yl)-2-methyloxolan-2-yl]propan-2-one
4-{[(4s,5s)-4,5-dimethyl-1,3-dioxolan-2-yl]methyl}phenol
(4s)-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-4-ol
5-(hydroxymethyl)-3-(3-methylbut-2-en-1-yl)-3h-oxepin-2-one
2-(hydroxymethyl)-3-[(1e)-4-hydroxypent-1-en-1-yl]phenol
(3s)-3,5,7-trimethyl-3,4-dihydro-1h-2-benzopyran-6,8-diol
2-[(1e)-3-hydroxy-3-methylbut-1-en-1-yl]-4-(hydroxymethyl)phenol
(3s)-8-methoxy-3,5-dimethyl-3,4-dihydro-1h-2-benzopyran-6-ol
(2s)-2-(2-hydroxypropan-2-yl)-6-methyl-2,3-dihydro-1-benzofuran-5-ol
2-(5-propyloxolan-2-ylidene)cyclopentane-1,3-dione
2-(hydroxymethyl)-3-[(1e,4r)-4-hydroxypent-1-en-1-yl]phenol
6,7-dihydroxy-1,8a-dimethyl-1,6,7,8-tetrahydronaphthalen-2-one
[(1s,5s)-4-oxo-5-[(2z)-pent-2-en-1-yl]cyclopent-2-en-1-yl]acetic acid
2,3,5-trimethyl-6-[(2r)-3-oxobutan-2-yl]pyran-4-one
(1r,6r,7r,8ar)-6,7-dihydroxy-1,8a-dimethyl-1,6,7,8-tetrahydronaphthalen-2-one
3-(1-hydroxyethyl)-6-[(2e)-pent-2-en-2-yl]pyran-2-one
2,3,5-trimethyl-6-[(2s)-3-oxobutan-2-yl]pyran-4-one
1-(3,4-dihydroxyphenyl)-2-propen-1-ol; (ξ)-form,tri-me ether
{"Ingredient_id": "HBIN001030","Ingredient_name": "1-(3,4-dihydroxyphenyl)-2-propen-1-ol; (\u03be)-form,tri-me ether","Alias": "NA","Ingredient_formula": "C12H16O3","Ingredient_Smile": "NA","Ingredient_weight": "208.25","OB_score": "NA","CAS_id": "84744-55-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9692","PubChem_id": "NA","DrugBank_id": "NA"}
6-(4-hydroxyphenyl)-4-hydroxyhexan-2-one
{"Ingredient_id": "HBIN012028","Ingredient_name": "6-(4-hydroxyphenyl)-4-hydroxyhexan-2-one","Alias": "NA","Ingredient_formula": "C12H16O3","Ingredient_Smile": "CC(=O)CC(CCC1=CC=C(C=C1)O)O","Ingredient_weight": "208.25 g/mol","OB_score": "9.488706206","CAS_id": "NA","SymMap_id": "SMIT02758","TCMID_id": "NA","TCMSP_id": "MOL000080","TCM_ID_id": "NA","PubChem_id": "86069320","DrugBank_id": "NA"}