Exact Mass: 234.2096
Exact Mass Matches: 234.2096
Found 500 metabolites which its exact mass value is equals to given mass value 234.2096,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Curcumenol
Curcumenol is a sesquiterpenoid. (3S,3aS,6R,8aS)-3,8-Dimethyl-5-(propan-2-ylidene)-2,3,4,5,6,8a-hexahydro-1H-3a,6-epoxyazulen-6-ol is a natural product found in Curcuma longa and Curcuma phaeocaulis with data available. D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065692 - Cytochrome P-450 CYP3A Inhibitors 4-Epicurcumenol is a constituent of rhizomes of Curcuma zedoaria (zedoary). Curcumenol ((+)-Curcumenol) is a potent CYP3A4 inhibitor with an IC50 of 12.6 μM, which is one of constituents in the plants of medicinally important genus of Curcuma zedoaria, with neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. Curcumenol ((+)-Curcumenol) suppresses Akt-mediated NF-κB activation and p38 MAPK signaling pathway in LPS-stimulated BV-2 microglial cells[1][2]. Curcumenol ((+)-Curcumenol) is a potent CYP3A4 inhibitor with an IC50 of 12.6 μM, which is one of constituents in the plants of medicinally important genus of Curcuma zedoaria, with neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. Curcumenol ((+)-Curcumenol) suppresses Akt-mediated NF-κB activation and p38 MAPK signaling pathway in LPS-stimulated BV-2 microglial cells[1][2].
Angustifoline
Angustifoline is a member of quinolizidines and a cyclic ketone. 4-(Prop-2-en-1-yl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is a natural product found in Haplophyllum thesioides, Lupinus hintonii, and other organisms with data available. CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 54 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 18 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 33 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 40 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 25 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 10 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 3
13-Hydroxygermacrone
13-Hydroxygermacrone is a germacrane sesquiterpenoid.
Fukinanolid
Bakkenolide A is a sesquiterpenoid. Bakkenolide A is a natural product found in Camptacra gracilis, Parasenecio hastatus, and other organisms with data available. See also: Petasites hybridus root (part of). Bakkenolide A is a natural product extracted from Petasites tricholobus. Bakkenolide A inhibits leukemia by regulation of HDAC3 and PI3K/Akt-related signaling pathways[1].
Lidocaine
Lidocaine is only found in individuals that have used or taken this drug. It is a local anesthetic and cardiac depressant used as an antiarrhythmia agent. Its actions are more intense and its effects more prolonged than those of procaine but its duration of action is shorter than that of bupivacaine or prilocaine. [PubChem]Lidocaine stabilizes the neuronal membrane by inhibiting the ionic fluxes required for the initiation and conduction of impulses thereby effecting local anesthetic action. Lidocaine alters signal conduction in neurons by blocking the fast voltage gated sodium (Na+) channels in the neuronal cell membrane that are responsible for signal propagation. With sufficient blockage the membrane of the postsynaptic neuron will not depolarize and will thus fail to transmit an action potential. This creates the anaesthetic effect by not merely preventing pain signals from propagating to the brain but by aborting their birth in the first place. D - Dermatologicals > D04 - Antipruritics, incl. antihistamines, anesthetics, etc. > D04A - Antipruritics, incl. antihistamines, anesthetics, etc. > D04AB - Anesthetics for topical use C - Cardiovascular system > C05 - Vasoprotectives > C05A - Agents for treatment of hemorrhoids and anal fissures for topical use > C05AD - Local anesthetics C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BB - Antiarrhythmics, class ib D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations > R02AD - Anesthetics, local S - Sensory organs > S02 - Otologicals > S02D - Other otologicals > S02DA - Analgesics and anesthetics S - Sensory organs > S01 - Ophthalmologicals > S01H - Local anesthetics > S01HA - Local anesthetics N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BB - Amides COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent CONFIDENCE standard compound; EAWAG_UCHEM_ID 2572 D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker KEIO_ID L034; [MS2] KO009034 KEIO_ID L034 Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Lidocaine (Lignocaine) inhibits sodium channels involving complex voltage and using dependence[1]. Lidocaine decreases growth, migration and invasion of gastric carcinoma cells via up-regulating miR-145 expression and further inactivation of MEK/ERK and NF-κB signaling pathways. Lidocaine is an amide derivative and has potential for the research of ventricular arrhythmia[2].
Sparteine
Sparteine is a quinolizidine alkaloid and a quinolizidine alkaloid fundamental parent. Sparteine is a plant alkaloid derived from Cytisus scoparius and Lupinus mutabilis which may chelate calcium and magnesium. It is a sodium channel blocker, so it falls in the category of class 1a antiarrhythmic agents. Sparteine is not currently FDA-approved for human use, and its salt, sparteine sulfate, is one of the products that have been withdrawn or removed from the market for reasons of safety or effectiveness. Sparteine is a natural product found in Ormosia coarctata, Thermopsis chinensis, and other organisms with data available. A quinolizidine alkaloid isolated from several FABACEAE including LUPINUS; SPARTIUM; and CYTISUS. It has been used as an oxytocic and an anti-arrhythmia agent. It has also been of interest as an indicator of CYP2D6 genotype. See also: Cytisus scoparius flowering top (part of). C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D012102 - Reproductive Control Agents > D010120 - Oxytocics Annotation level-1 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 53 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 39 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 32 INTERNAL_ID 24; CONFIDENCE Reference Standard (Level 1) CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 24 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 17 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 9 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.395 beta-Isosparteine is a natural product found in Ulex airensis, Ulex densus, and other organisms with data available. A quinolizidine alkaloid isolated from several FABACEAE including LUPINUS; SPARTIUM; and CYTISUS. It has been used as an oxytocic and an anti-arrhythmia agent. It has also been of interest as an indicator of CYP2D6 genotype. (+)-Sparteine is a natural product found in Baptisia australis, Dermatophyllum secundiflorum, and other organisms with data available. A quinolizidine alkaloid isolated from several FABACEAE including LUPINUS; SPARTIUM; and CYTISUS. It has been used as an oxytocic and an anti-arrhythmia agent. It has also been of interest as an indicator of CYP2D6 genotype. (-)-Sparteine is a natural alkaloid isolated from beans. (-)-Sparteine is a natural alkaloid isolated from beans. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons.
alpha-Isosparteine
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D012102 - Reproductive Control Agents > D010120 - Oxytocics
Isocurcumenol
Isocurcumenol is a constituent of Curcuma zedoaria (zedoary). Constituent of Curcuma zedoaria (zedoary) Isocurcumenol, an estrogen receptor alpha (ERα) inhibitor isolated from Curcuma zedoaria Rhizomes, possesses anti-tumor acticity, with IC50 values of 99.1μg/mL and 178.2 μg/mL in DLA and KB cells, respectively[1][2]. Isocurcumenol, an estrogen receptor alpha (ERα) inhibitor isolated from Curcuma zedoaria Rhizomes, possesses anti-tumor acticity, with IC50 values of 99.1μg/mL and 178.2 μg/mL in DLA and KB cells, respectively[1][2].
Saussurea lactone
Saussurea lactone is found in herbs and spices. Saussurea lactone is from costus root oil (Saussurea lappa), probably formed by pyrolysis of Dihydrocostunolid From costus root oil (Saussurea lappa), probably formed by pyrolysis of Dihydrocostunolide. Saussurea lactone is found in herbs and spices.
Procurcumenol
Procurcumenol is found in herbs and spices. Procurcumenol is a constituent of the dried rhizomes of Curcuma zedoaria (zedoary) and Curcuma longa (turmeric). Constituent of the dried rhizomes of Curcuma zedoaria (zedoary) and Curcuma longa (turmeric). Procurcumenol is found in turmeric and herbs and spices.
Curcumanolide A
Constituent of the crude drug zedoary (Curcuma zedoaria). Curcumanolide B is from Curcuma zedoaria (zedoary).
Dihydroisoalantolactone
Dihydroisoalantolactone is found in herbs and spices. Dihydroisoalantolactone is isolated from roots of Inula helenium (elecampane Isolated from roots of Inula helenium (elecampane). Dihydroisoalantolactone is found in herbs and spices.
Oxysolavetivone
Intermediate metabolite in the pathway to the phytoalexins of potato. Oxysolavetivone is found in alcoholic beverages and potato. Oxysolavetivone is found in alcoholic beverages. Intermediate metabolite in the pathway to the phytoalexins of potat
(Z)-alpha-Bergamotenoic acid
(Z)-alpha-Bergamotenoic acid is a flavouring ingredient. (Z)-alpha-Bergamotenoic acid is a constituent of East Indian sandalwood oil. Flavouring ingredient. Constituent of East Indian sandalwood oil
(5Z,8Z)-1,5,8-Heptadecatriene
(5Z,8Z)-1,5,8-Heptadecatriene is found in tea. (5Z,8Z)-1,5,8-Heptadecatriene is a constituent of the essential oil of Tussilago farfara (coltsfoot). Constituent of the essential oil of Tussilago farfara (coltsfoot). (5Z,8Z)-1,5,8-Heptadecatriene is found in tea.
Petasalbin
Constituent of coltsfoot and Petasites japonicus (sweet coltsfoot). Petasalbin is found in tea, giant butterbur, and green vegetables. Petasalbin is found in giant butterbur. Petasalbin is a constituent of coltsfoot and Petasites japonicus (sweet coltsfoot)
2,6-Di-tert-butyl-4-ethylphenol
2,6-Di-tert-butyl-4-ethylphenol, also known as nocrac m 17 or 4-ethyl-2,6-di-tert-butylphenol, belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety. 2,6-Di-tert-butyl-4-ethylphenol has been detected, but not quantified, in fruits and tea. This could make 2,6-di-tert-butyl-4-ethylphenol a potential biomarker for the consumption of these foods. 2,6-Di-tert-butyl-4-ethylphenol is a potentially toxic compound. Reported as a constituent of mango and green tea leaves. 2,6-Di-tert-butyl-4-ethylphenol is found in tea and fruits.
4,10-Longipinanedione
4,10-Longipinanedione is found in herbs and spices. 4,10-Longipinanedione is a constituent of the flowers of Tanacetum vulgare (tansy) Constituent of the flowers of Tanacetum vulgare (tansy). 4,10-Longipinanedione is found in herbs and spices.
alpha-Rotunol
beta-Rotunol is found in root vegetables. beta-Rotunol is a constituent of tubers of nut grass, Cyperus rotundus Constituent of tubers of nut grass, Cyperus rotundus. beta-Rotunol is found in root vegetables.
4,6-Decadiyn-1-ol isovalerate
4,6-Decadiyn-1-ol isovalerate is found in fats and oils. 4,6-Decadiyn-1-ol isovalerate is isolated from Carthamus tinctorius (safflower). Isolated from Carthamus tinctorius (safflower). 4,6-Decadiyn-1-ol isovalerate is found in fats and oils and herbs and spices.
1,10-Epoxygermacrone
1,10-Epoxygermacrone is found in green vegetables. 1,10-Epoxygermacrone is a constituent of the roots of Smyrnium olusatrum (alexanders) Constituent of the roots of Smyrnium olusatrum (alexanders). 1,10-Epoxygermacrone is found in green vegetables.
9-Pentadecene-12,14-diyne-1,11-diol
9-Pentadecene-12,14-diyne-1,11-diol is found in fruits. 9-Pentadecene-12,14-diyne-1,11-diol is isolated from Solanum melongena (aubergine) calluse Isolated from Solanum melongena (aubergine) calluses. 9-Pentadecene-12,14-diyne-1,11-diol is found in fruits and eggplant.
(4alpha,5alpha)-11-Eremophilene-2,9-dione
(4alpha,5alpha)-11-Eremophilene-2,9-dione is found in citrus. (4alpha,5alpha)-11-Eremophilene-2,9-dione is a constituent of grapefruit (Citrus paradisi) juice Constituent of grapefruit (Citrus paradisi) juice. (4alpha,5alpha)-11-Eremophilene-2,9-dione is found in citrus.
3-Phenylpropyl hexanoate
3-Phenylpropyl hexanoate is a flavouring ingredient. Flavouring ingredient
2-Methyl-4-phenyl-2-butyl 2-methylpropanoate
2-Methyl-4-phenyl-2-butyl 2-methylpropanoate is a flavouring ingredient with a fruit juice flavour. Flavouring ingredient with a fruit juice flavour
4-Methylphenyl octanoate
4-Methylphenyl octanoate is a flavouring ingredient. Flavouring ingredient
7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one
7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one is found in herbs and spices. 7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one is a constituent of the oil of turmeric, Curcuma longa. Constituent of the oil of turmeric, Curcuma longa. 7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one is found in herbs and spices.
xi-2-Hydroxy-1,3,5-bisabolatrien-9-one
xi-2-Hydroxy-1,3,5-bisabolatrien-9-one is found in herbs and spices. xi-2-Hydroxy-1,3,5-bisabolatrien-9-one is a constituent of Curcuma longa (turmeric). Constituent of Curcuma longa (turmeric). xi-2-Hydroxy-1,3,5-bisabolatrien-9-one is found in herbs and spices.
5-Methyl-2,5-di-1-pyrrolidinyl-2-cyclopenten-1-one
Proline-derived Maillard product. Proline-derived Maillard product
3,5-Di-tert-butyl-4-hydroxybenzaldehyde
3,5-Di-tert-butyl-4-hydroxybenzaldehyde, also known as BHT-CHO or 4-formyl-2,6-di-tert-butylphenol, belongs to the class of organic compounds known as hydroxybenzaldehydes. These are organic aromatic compounds containing a benzene ring carrying an aldehyde group and a hydroxyl group. BHT-CHO is a metabolite of 2,6-di-tert-butyl-4-methylphenol (BHA), a synthetic phenolic antioxidant (SPA). SPAs are a family of chemicals used widely in foods, polymers, and cosmetics as radical trapping agents to slow down degradation due to oxidation. Given their widespread use, human exposure is unavoidable and there is public concern regarding environmental contamination by these chemicals. BHT-CHO was detected in human urine (PMID: 31265952).
(-)-Sparteine
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D012102 - Reproductive Control Agents > D010120 - Oxytocics (-)-Sparteine is a natural alkaloid isolated from beans. (-)-Sparteine is a natural alkaloid isolated from beans.
1-Acetyl-2-(3-pyrrolidino-1-propynyl)piperidine
Apo-11-zeaxanthinal
Apo-11-zeaxanthinal is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. Apo-11-zeaxanthinal is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Apo-11-zeaxanthinal can be found in a number of food items such as pepper (c. annuum), orange bell pepper, italian sweet red pepper, and red bell pepper, which makes apo-11-zeaxanthinal a potential biomarker for the consumption of these food products.
Germacranolide
Germacranolides are a group of sesquiterpene lactones. Germacranolide is found in burdock and dandelion.
4-Ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-trien-1-al
4-ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-trien-1-al is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 4-ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-trien-1-al can be found in tea, which makes 4-ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-trien-1-al a potential biomarker for the consumption of this food product.
(Z,Z)-1,8,11-Heptadecatriene
(z,z)-1,8,11-heptadecatriene is a member of the class of compounds known as alkatrienes. Alkatrienes are acyclic hydrocarbons that contain exactly three carbon-to-carbon double bonds (z,z)-1,8,11-heptadecatriene can be found in burdock and safflower, which makes (z,z)-1,8,11-heptadecatriene a potential biomarker for the consumption of these food products.
Fukinanolide
Fukinanolide is a member of the class of compounds known as terpene lactones. Terpene lactones are prenol lipids containing a lactone ring. Fukinanolide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Fukinanolide can be found in burdock and giant butterbur, which makes fukinanolide a potential biomarker for the consumption of these food products. Bakkenolide A is a natural product extracted from Petasites tricholobus. Bakkenolide A inhibits leukemia by regulation of HDAC3 and PI3K/Akt-related signaling pathways[1].
Octyl benzoate
Octyl benzoate, also known as octyl benzoic acid, is a member of the class of compounds known as benzoic acid esters. Benzoic acid esters are ester derivatives of benzoic acid. Octyl benzoate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Octyl benzoate is a balsam and fruity tasting compound found in lemon balm, which makes octyl benzoate a potential biomarker for the consumption of this food product.
Isocurcumenol
Isocurcumenol is a natural product found in Curcuma zedoaria, Curcuma harmandii, and other organisms with data available. Isocurcumenol, an estrogen receptor alpha (ERα) inhibitor isolated from Curcuma zedoaria Rhizomes, possesses anti-tumor acticity, with IC50 values of 99.1μg/mL and 178.2 μg/mL in DLA and KB cells, respectively[1][2]. Isocurcumenol, an estrogen receptor alpha (ERα) inhibitor isolated from Curcuma zedoaria Rhizomes, possesses anti-tumor acticity, with IC50 values of 99.1μg/mL and 178.2 μg/mL in DLA and KB cells, respectively[1][2].
alpha-santalenoic acid
A sesquiterpenoid that is (+)-alpha-santalene in which one of the methyl groups attached to the C=C double bond has been oxidised to form the corresponding carboxylic acid.
Dihydroallitrisin
11beta,13-Dihydrogeigeranolode
6alpha,7beta-Epoxy-2,9-humuladien-14-al
(3R-trans)-2,3,4,4a,5,6-Hexahydro-3-hydroxy-4a-methyl-7-(1-methylethyl)-1-naphthalenecarboxaldehyde
(E,E)-(-)-10-hydroxy-2,6,10-trimethyl-2,5,7,11-Dodecatetraen-4-one
Punctaporonin G
(-)-1S,9R-9-Hydroxy-2,2,5,9-tetramethylbicyclo[6.3.0]undeca-4,7-dien-6-one
5H-Cyclopropa[a]naphthalen-5-one, 1,1a,2,3,6,7,7a,7b-octahydro-3-hydroxy-1,1,7,7a-tetramethyl-
(4R,4aR,7R)-4-hydroxy-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
6,6,9a-Trimethyl-4,5,5a,6,7,8,9,9a-octahydronaphtho[1,2-c]furan-1(3H)-one #
[3R-(3R*,3aR*,5E,9E,11aS*)]-3a,4,7,8,11,11a-Hexahydro-3,6,10-trimethylcyclodeca[b]furan-2(3H)-one
5-[3-(3,3-Dimethyloxiranyl)-1-methylenepropyl]-2-methyl-2-cyclohexen-1-one
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
[S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal
3-(5-hydroxy-3-methylpenta-1,3-dienyl)-2,4,4-trimethylcyclohex-2-en-1-one
[S-(R*,S*)]-6-(1,5-Dimethyl-3-oxo-4-hexenyl)-3-methyl-2-cyclohexen-1-one
Shizukafuranol
[S-(E)]-2-(1-Hydroxy-4-methyl-3-cyclohexen-1-yl)-6-methyl-2,5-heptadien-4-one
Cnicothamnal
Crispatanolide
7beta,8beta:8alpha,12-Diepoxy-11(13)-eremophilene
Xanthanene
QING HAU ACID
Artemisinic acid (Qing Hao acid), an amorphane sesquiterpene isolated from Artemisia annua L., possesses a variety of pharmacological activity, such as antimalarial activity, anti-tumor activity, antipyretic effect, antibacterial activity, allelopathy effect and anti-adipogenesis effect[1]. Artemisinic acid (Qing Hao acid), an amorphane sesquiterpene isolated from Artemisia annua L., possesses a variety of pharmacological activity, such as antimalarial activity, anti-tumor activity, antipyretic effect, antibacterial activity, allelopathy effect and anti-adipogenesis effect[1].
Volvalerenic acid A
Dihydroinunolide
5-Hydroxyzerumbone
A sesquiterpenoid that is zerumbone substituted by a hydroxy group at position 5. Isolated from the rhizomes Zingiber zerumbet, it has been found to inhibit lipopolysaccharide-induced nitric oxide production.
(1R,4Z,9S)-4-(hydroxymethyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
Iso E Super
CONFIDENCE standard compound; INTERNAL_ID 2503
(3aalpha,9S)-Decahydro-5,5,8aalpha-trimethyl-1,2beta,4beta-methenoazulene-1alpha-carboxylic acid
(1R,3S,4aR,6R,7aR)-(-)-3-ethenyl-1-methyl-4-methylene-6-(1-methylethyl)-tetrahydrocyclopenta[c]pyran-5(1H,3H,6H)-one|hodgsonox H
10xi-Eremophil-7(11)-en-8,9-dion|10xi-eremophil-7(11)-ene-8,9-dione|Eremophil-7(11)-en-8,9-dion
2-methyl-5-(5-hydroxy-1,5-dimethyl-3-hexenyl)phenol|2-methyl-5-(5-hydroxy-1,5-dimethyl-3-hexenyl)-phenol
1beta-hydroxyeudesma-4,11-dien-15-al|rel-(4R,4aR,7R)-2,3,4,4a,5,6,7,8-octahydro-4-hydroxy-4a-methyl-7-(1-methylethenyl)naphthalene-1-carbaldehyde
(3aR,9S,11aS,E)-5,9-dimethyl-1-methylene-3,3a,7,8,9,10,11,11a-octahydro-1H-cylopenta[10]annulen-2(6H)-one|isodihydrocostunolide
valerenic acid
A monocarboxylic acid that is 2-methylprop-2-enoic acid which is substituted at position 3 by a 3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl group. A bicyclic sesquiterpenoid constituent of the essential oil of the Valerian plant. Valerenic acid ((-)-Valerenic Acid), a sesquiterpenoid, is an orally active positive allosteric modulator of GABAA receptors. Valerenic acid is also a partial agonist of the 5-HT5a receptor. Valerenic acid mediates anxiolytic activity via GABAA receptors containing the β3 subunit. Valerenic acid also exhibits potent antioxidant properties[1][2][3].
(7R,10R)-carota-1,4-dienoic acid|carota-1,4-dienoic acid
1-Hydroxycyclocolorenon|1alpha-hydroxy-(+)-cyclocolorenone|4-aromadendrene-1alpha-ol-3-one
(5R)-2,6,9-humulatrien-5-ol-8-one|5-hydroxy-2E,6E,9E-humulatrien-8-one|5-hydroxyzerumbone
(1beta,7(11)Z)-1-Hydroxy-5,7(11)-eudesmadien-12-al|vernostipulal A
2beta-hydroxy-10alpha-cadina-6(7),11(12)-dien-3-one|ligusongaricone
(-)-cucumin H|(1S,3S,8S)-3-hydroxy-1,4,4,8-tetramethyltricyclo[6.3.0.0(2,6)]undec-2(6)-en-7-one
3-(4-methyl-3-pentenyl)-3-cyclohexenyl propyl ketone
(-)-4-hydroxymethyl-2-(1,2,2-trimethylcyclopentyl)phenol|(-)-Herbertene-1,12-diol|(-)-herbertene-1,2-diol|4-hydroxymethyl-2-[(1S)-1,2,2-trimethylcyclopentyl]phenol
11-Hydroxy-6,9-eremophiladien-8-one|11-hydroxyeremophil-6,9-dien-8-one
(8R)-6,7,8,8a,-tetrahydro-5-(2-hydroxy-1-methylethyl)-3,8-dimethyl-1H-azulen-2-one
3,4,4a,5,6,7,8,8a-Octahydro-2,5,5,8a-tetramethylnaphthalene-1-acetaldehyde
4-(4-methyl-3-pentenyl)-3-cyclohexenyl propyl ketone
(2S,8S,8aR)-2,4,6,7,8,8a-hexahydro-2-hydroxy-3,8-dimethyl-4-(1-methylethylidene)azulen-5(1H)-one|Melicodenone A
10-methyl-6,7-dimethylmethylene-8alpha-hydroxy-4-aldehyde-(4Z,10E)dicyclodecadiene|heishuixiecaoline B
(E)-3-((1S,2S,4aR,6R,8aS)-2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)acrylic acid|3-(2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)propenoic acid|monascusic acid B
(+)-camerarialdehyde|2-[(2S,4aR,5S,8aR)-decahydro-(1-methylene-2-hydroxy-4a-methyl)naphthalenyl]propenal
(+)-(4R,5S,7R)-13-hydroxynootkatone|13-hydroxy-(+)-nootkatone|13-hydroxynootkatone
(4abeta,7beta,8abeta)-3,4,4a,5,6,7,8,8a-octahydro-7-[1-(hydroxymethyl)ethenyl]-4a-methylnaphthalene-1-carboxaldehyde
(3aR,5aS,6S,7S,8aR)-7-hydroxy-1,2,3a,6-tetramethyl-4,5,5a,6,7,8-hexahydrocyclopenta[c]pentalen-3(3aH)-one|10-hydroxy-5-oxosilphiperfol-6-ene|suberosanone C
2alpha-Hydroxycyperon|2beta-hydroxy-alpha-cyperone
Clovan-2,9-dion|clovan-2,9-dione|clovane-2,9-dione
4-formyl-10-hydroxymethyl-11,11-dimethylbicyclogermacren-4E (5),10Z (1)-diene|volvalerenal G
(3aS)-3xi,6xi,9-Trimethyl-(3ar,6axi,9bt)-3a,4,5,6,6a,7,8,9b-octahydro-3H-azuleno[4,5-b]furan-2-on|(3aS)-3xi,6xi,9-trimethyl-(3ar,6axi,9bt)-3a,4,5,6,6a,7,8,9b-octahydro-3H-azuleno[4,5-b]furan-2-one
(1R,3S,6S,7aR)-(-)-3-ethenyl-1,4-dimethyl-6-(1-methylethyl)-7,7a-dihydrocyclopenta[c]pyran-5(1H,3H,6H)-one|hodgsonox E
(5S,6R,7R)-2-oxocadinan-1(10),3-dien-5-ol|tatarinowin A
(6S,8R)-6,7,8,8a,4,5-tetrahydro-6-hydroxy-3,8-dimethyl-5-(1-methylethyl)-1H-azulen-2-one
3,5,5-Trimethyl-7-isopropyl-3-hydroxy-2,3,4,5-tetrahydro-1H-inden-1-one
6alpha-6-Hydroxy-9-isocapnellen-8-one|6alpha-hydroxyisocapnell-9-en-8-one
(4E,6E,11Z)-4,6,11-Hexadecatrienal|(4E,6E,11Z)-hexadeca-4,6,11-trienal|4E,6E,11Z-hexadecatrienal
1,2,2a,3,6,7,8,8a-octahydro-7-hydroxy-2a,7,8-trimethylacenaphthylen-4(4H)-one
6-[1-(Hydroxymethyl)vinyl]-4,8a-dimethyl-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone #
(1R,4aS,6R,7aR)-(+)-3-ethenyl-1,4-dimethyl-6-(1-methylethyl)-7,7a-dihydrocyclopenta[c]pyran-5(1H,4aH,6H)-one|hodgsonox G
flavalin A
A sesquiterpenoid of the class of nardosinane-type terpenoids isolated from the Formosan soft coral Lemnalia flava, and has been shown to exhibit neuroprotective activity.
3-formyl-5-(2,6,6-trimethyl-2-cyclohexenyl)-3-pentenal
(4aR,9aR)-2,3,4,4a,5,6,9,9a-octahydro-4,4-dimethyl-1-methylidene-1H-benzocycloheptene-7-carboxylic acid|ximonicane
(4S,9S,10R)-lippifoli-1(6)-en-4-ol-5-one|4beta-form-Hydroxy-1(6)-ippifolien-5-one
2-[(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-2-butenedial
4,9,9-trimethyl-2,4,5,6,7,8-hexahydro-3h-3a,7-methanoazulene-1-carboxylic acid
(+)-(6S,1S,5S)-2-methyl-5-(6-methyl-2-methylenebicyclo[3.1.1]hept-6-yl)-pent-2-enoic acid|(+)-(E)-endo-beta-bergamoten-12-oic acid|(+)-(E)-endo-beta-Bergamotenoic acid|(E)-endo-beta-bergamoten-12-oicacid|beta-(E)-endo-bergamoten-12-oic acid
(E)-3-methyl-5-(cis-2,5,6,6-tetramethylcyclohex-2-yl)pent-4-en-2-one
Curcumenone
Curcumenone is a sesquiterpenoid. Bicyclo(4.1.0)heptan-3-one, 1-methyl-4-(1-methylethylidene)-7-(3-oxobutyl)-, (1S,6R,7R)- is a natural product found in Curcuma aeruginosa, Curcuma aromatica, and other organisms with data available. Curcumenone is a major constituent of the plants of medicinally important genus of Curcuma. Curcumenone, a caraborane type sesquiterpene has been reported to be a vasorelaxant, hepatoprotective and an effective inhibitor of intoxication[1]. Curcumenone is a major constituent of the plants of medicinally important genus of Curcuma. Curcumenone, a caraborane type sesquiterpene has been reported to be a vasorelaxant, hepatoprotective and an effective inhibitor of intoxication[1].
zealexin A1
A sesquiterpene phytoalexin that is (S)-beta-macrocarpene in which the methyl group that is attached to a double bond has undergone formal oxidation to give the corresponding carboxylic acid. It is produced by maize (Zea mays) to provide biochemical protection against fungal infection.
Procurcumenol
Procurcumenol is a sesquiterpenoid. Procurcumenol is a natural product found in Curcuma aromatica, Curcuma longa, and other organisms with data available.
Nardoguaianone J
Nardoguaianone J is a natural product found in Nardostachys jatamansi with data available.
Neoprocurcumenol
Neoprocurcumenol is a natural product found in Curcuma aromatica with data available.
lidocaine
D - Dermatologicals > D04 - Antipruritics, incl. antihistamines, anesthetics, etc. > D04A - Antipruritics, incl. antihistamines, anesthetics, etc. > D04AB - Anesthetics for topical use C - Cardiovascular system > C05 - Vasoprotectives > C05A - Agents for treatment of hemorrhoids and anal fissures for topical use > C05AD - Local anesthetics C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BB - Antiarrhythmics, class ib D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations > R02AD - Anesthetics, local S - Sensory organs > S02 - Otologicals > S02D - Other otologicals > S02DA - Analgesics and anesthetics S - Sensory organs > S01 - Ophthalmologicals > S01H - Local anesthetics > S01HA - Local anesthetics N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BB - Amides COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 1212 CONFIDENCE Parent Substance with Reference Standard (Level 1); INTERNAL_ID 800 CONFIDENCE Reference Standard (Level 1) Lidocaine (Lignocaine) inhibits sodium channels involving complex voltage and using dependence[1]. Lidocaine decreases growth, migration and invasion of gastric carcinoma cells via up-regulating miR-145 expression and further inactivation of MEK/ERK and NF-κB signaling pathways. Lidocaine is an amide derivative and has potential for the research of ventricular arrhythmia[2].
Lidocain
D - Dermatologicals > D04 - Antipruritics, incl. antihistamines, anesthetics, etc. > D04A - Antipruritics, incl. antihistamines, anesthetics, etc. > D04AB - Anesthetics for topical use C - Cardiovascular system > C05 - Vasoprotectives > C05A - Agents for treatment of hemorrhoids and anal fissures for topical use > C05AD - Local anesthetics C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BB - Antiarrhythmics, class ib D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations > R02AD - Anesthetics, local S - Sensory organs > S02 - Otologicals > S02D - Other otologicals > S02DA - Analgesics and anesthetics S - Sensory organs > S01 - Ophthalmologicals > S01H - Local anesthetics > S01HA - Local anesthetics N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BB - Amides COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent CONFIDENCE standard compound; INTERNAL_ID 4102 D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Lidocaine (Lignocaine) inhibits sodium channels involving complex voltage and using dependence[1]. Lidocaine decreases growth, migration and invasion of gastric carcinoma cells via up-regulating miR-145 expression and further inactivation of MEK/ERK and NF-κB signaling pathways. Lidocaine is an amide derivative and has potential for the research of ventricular arrhythmia[2].
C15H22O2_1H-3a,6-Methanoazulene-3-carboxylic acid, octahydro-7,7-dimethyl-8-methylene-, (3S,3aR,6R,8aS)
C15H22O2_(1R,4Z,9S)-4-(Hydroxymethyl)-11,11-dimethyl-8-methylenebicyclo[7.2.0]undec-4-en-3-one
C15H26N2_7,14-Methano-2H,6H-dipyrido[1,2-a:1,2-e][1,5]diazocine, dodecahydro-, (7S,7aR,14S,14aS)
C15H22O2_1,7,7-Trimethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene-4-carboxylic acid
C15H22O2_(2E)-5-(2,3-Dimethyltricyclo[2.2.1.0~2,6~]hept-3-yl)-2-methyl-2-pentenoic acid
C15H22O2_2-Naphthaleneacetic acid, 1,2,3,5,6,7,8,8a-octahydro-8,8a-dimethyl-alpha-methylene-, (2R,8S,8aR)
C15H22O2_3-Hydroxy-5-isopropylidene-3,8-dimethyl-2,3,3a,4,5,8a-hexahydro-6(1H)-azulenone
C15H22O2_(4aR,5R,6R)-6-Hydroxy-3-isopropylidene-4a,5-dimethyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone
(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enoic acid
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
Curcumenol
Constituent of Curcuma zedoaria (zedoary) and Curcuma longa (turmeric). Curcumenol is found in turmeric and herbs and spices. Curcumenol ((+)-Curcumenol) is a potent CYP3A4 inhibitor with an IC50 of 12.6 μM, which is one of constituents in the plants of medicinally important genus of Curcuma zedoaria, with neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. Curcumenol ((+)-Curcumenol) suppresses Akt-mediated NF-κB activation and p38 MAPK signaling pathway in LPS-stimulated BV-2 microglial cells[1][2]. Curcumenol ((+)-Curcumenol) is a potent CYP3A4 inhibitor with an IC50 of 12.6 μM, which is one of constituents in the plants of medicinally important genus of Curcuma zedoaria, with neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. Curcumenol ((+)-Curcumenol) suppresses Akt-mediated NF-κB activation and p38 MAPK signaling pathway in LPS-stimulated BV-2 microglial cells[1][2].
(1R,2S,5S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.0¹,⁵]undecane-2-carboxylic acid
Pachycarpine
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D012102 - Reproductive Control Agents > D010120 - Oxytocics CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 3 (-)-Sparteine is a natural alkaloid isolated from beans. (-)-Sparteine is a natural alkaloid isolated from beans. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons. (+)-Sparteine is a natural alkaloid acting as a ganglionic blocking agent. (+)-Sparteine competitively blocks nicotinic ACh receptor in the neurons.
(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enoic acid_major
(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enoic acid_53.3\\%
(E)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.02,6]heptan-3-yl)-2-methylpent-2-enoic acid_27.5\\%
2-[(2R,8S,8aR)-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid_major
(1R,2S,5S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.0¹,⁵]undecane-2-carboxylic acid_major
(1R,2S,5S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.0¹,⁵]undecane-2-carboxylic acid_5.9\\%
2-[(2R,8S,8aR)-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid
(1R,2S,5S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.0¹,?]undecane-2-carboxylic acid
(4alpha,5alpha)-11-Eremophilene-2,9-dione
(Z)-alpha-Bergamotenoic acid
(1alpha,4beta,5beta)-4-Hydroxy-7(11),10(14)-guaiadien-8-one
Cyclodehydroisolubimin
7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one
Rishitinol
5-Methyl-2,5-di-1-pyrrolidinyl-2-cyclopenten-1-one
1,1-Bicyclohexyl, 4-ethenyl-4-propyl-, (trans,trans)
2-[(1E)-2-(1-Cyclohexen-1-yl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-[4-(2-AMINO-ETHYL)-PHENYL]-N,N-DIETHYL-ACETAMIDE
N-(2,6-dimethylphenyl)-2-[1,1,2,2,2-pentadeuterioethyl(2,2,2-trideuterioethyl)amino]acetamide
TRANS-2-(1-CYCLOHEXENYL)VINYLBORONIC ACID PINACOL ESTER
(4AR,9BS)-2,3,4,4A,5,9B-HEXAHYDRO-2,8-DIMETHYL-1H-PYRIDO[4,3-B]INDOLE
(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane
SPIRO[2.5]OCT-5-EN-6-YL BORONIC ACID PINACOL ESTER
(1S,4aS,8aS)-Decahydro-5,5,8a-trimethyl-2-methylene-1-naphthaleneacetaldehyde
4-(Aminomethyl)-1-benzyl-4-(hydroxymethyl)piperidine
4-METHYL-3-OXO-3,4-DIHYDRO-2H-BENZO[1,4]OXAZINE-6-CARBOXYLIC ACID
2-(4,4-Dimethylcyclohexa-1,5-dien-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Ispronicline
C78272 - Agent Affecting Nervous System > C47796 - Cholinergic Agonist > C73579 - Nicotinic Agonist Ispronicline (TC-1734), an orally active, brain-selective α4β2 nicotine acetylcholine receptor (nAChR) partial agonist, has shown memory-enhancing properties in rodents and a good tolerability profile. Ispronicline binds to the α4β2 nAChR with high affinity (Ki=11 nM) and is highly selective to other nAChRs such as α7 nAChR and α3β4 nAChR[1][2].
Sparteine-sulfate
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia (-)-Sparteine is a natural alkaloid isolated from beans. (-)-Sparteine is a natural alkaloid isolated from beans.
Tetradecanoic acid Li salt
Stabiliser for food contact polypropylene and polypropylene copolymers
4-Ethyl-7,11-dimethyldodeca-trans-2-trans-6-1-o-trien-1-al
1-[4-(2,2,3-Trimethylcyclopent-3-enyl)cyclohex-3-enyl]ethanol
1-[3-(2,2,3-Trimethylcyclopent-3-enyl)cyclohex-3-enyl]ethanol
1-[2-[1-(2-Aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine
(1S,2R)-5-methoxy-1-methyl-2-(propylammonio)tetralin(1+)
genisteine
A quinolizidine alkaloid that is sparteine in which the hydrogen atom at position 6 is in the beta-configuration. D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D012102 - Reproductive Control Agents > D010120 - Oxytocics
(1r,4s,6r,10r)-1,4,12,12-tetramethyl-9-methylidene-5-oxatricyclo[8.2.0.0⁴,⁶]dodecane
(1r,2s,9r,10s)-10-(prop-2-en-1-yl)-7,11-diazatricyclo[7.3.1.0²,⁷]tridecan-6-one
1,1,4a,7-tetramethyl-4-methylidene-hexahydro-1ah-cyclopropa[e]azulen-7-ol
3-methyl-5-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)pent-4-en-2-one
3-Heptadecen-5-yne,(Z)-
{"Ingredient_id": "HBIN008575","Ingredient_name": "3-Heptadecen-5-yne,(Z)-","Alias": "NA","Ingredient_formula": "C17H30","Ingredient_Smile": "CCCCCCCCCCCC#CC=CCC","Ingredient_weight": "234.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41020","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5367448","DrugBank_id": "NA"}
492-06-8
{"Ingredient_id": "HBIN010151","Ingredient_name": "492-06-8","Alias": "Prestwick2_000618; SPBio_002775; STOCK1N-51759; 7,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocine, dodecahydro-, (7R-(7alpha,7abeta,14alpha,14abeta))-; Prestwick0_000618; Prestwick1_000618","Ingredient_formula": "C15H26N2","Ingredient_Smile": "C1CCN2CC3CC(C2C1)CN4C3CCCC4","Ingredient_weight": "234.38","OB_score": "68.34865929","CAS_id": "492-06-8","SymMap_id": "SMIT06938","TCMID_id": "NA","TCMSP_id": "MOL005137","TCM_ID_id": "NA","PubChem_id": "6101950","DrugBank_id": "NA"}
