Exact Mass: 182.1095444

Exact Mass Matches: 182.1095444

Found 500 metabolites which its exact mass value is equals to given mass value 182.1095444, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Harman

1-methyl-9H-pyrido[3,4-b]indole

C12H10N2 (182.084394)


Harman is an indole alkaloid fundamental parent with a structure of 9H-beta-carboline carrying a methyl substituent at C-1. It has been isolated from the bark of Sickingia rubra, Symplocus racemosa, Passiflora incarnata, Peganum harmala, Banisteriopsis caapi and Tribulus terrestris, as well as from tobacco smoke. It is a specific, reversible inhibitor of monoamine oxidase A. It has a role as an anti-HIV agent, a plant metabolite and an EC 1.4.3.4 (monoamine oxidase) inhibitor. It is an indole alkaloid, an indole alkaloid fundamental parent and a harmala alkaloid. Harman is a natural product found in Ophiopogon, Strychnos johnsonii, and other organisms with data available. An indole alkaloid fundamental parent with a structure of 9H-beta-carboline carrying a methyl substituent at C-1. It has been isolated from the bark of Sickingia rubra, Symplocus racemosa, Passiflora incarnata, Peganum harmala, Banisteriopsis caapi and Tribulus terrestris, as well as from tobacco smoke. It is a specific, reversible inhibitor of monoamine oxidase A. Isolated from roots of Panax ginseng and Codonopsis lanceolata (todok). Struct. has now been shown to be identical with 1-Acetyl-b-carboline CHK59-M Harman is found in chicory. Harman is an alkaloid from the may pop (Passiflora incarnata, Passifloraceae) and many other Passiflora sp [Raw Data] CB042_Harman_pos_30eV_CB000019.txt [Raw Data] CB042_Harman_pos_20eV_CB000019.txt [Raw Data] CB042_Harman_pos_40eV_CB000019.txt [Raw Data] CB042_Harman_pos_10eV_CB000019.txt [Raw Data] CB042_Harman_pos_50eV_CB000019.txt [Raw Data] CB042_Harman_neg_50eV_000012.txt [Raw Data] CB042_Harman_neg_30eV_000012.txt [Raw Data] CB042_Harman_neg_40eV_000012.txt [Raw Data] CB042_Harman_neg_20eV_000012.txt [Raw Data] CB042_Harman_neg_10eV_000012.txt Harman. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=486-84-0 (retrieved 2024-06-29) (CAS RN: 486-84-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4]. Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4]. Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4].

   

Dacarbazine

Dacarbazine, Pharmaceutical Secondary Standard; Certified Reference Material

C6H10N6O (182.09160500000002)


Dacarbazine appears as white to ivory microcrystals or off-white crystalline solid. (NTP, 1992) (E)-dacarbazine is a dacarbazine in which the N=N double bond adopts a trans-configuration. An antineoplastic agent. It has significant activity against melanomas. (from Martindale, The Extra Pharmacopoeia, 31st ed, p564). Dacarbazine with Oblimersen is in clinical trials for the treatment of malignant melanoma. Dacarbazine is an Alkylating Drug. The mechanism of action of dacarbazine is as an Alkylating Activity. Dacarbazine (also known as DTIC) is an intravenously administered alkylating agent used in the therapy of Hodgkin disease and malignant melanoma. Dacarbazine therapy has been associated with serum enzyme elevations during therapy and occasional cases of severe and distinctive acute hepatic failure, probably caused by acute sinusoidal obstruction syndrome. Dacarbazine is a triazene derivative with antineoplastic activity. Dacarbazine alkylates and cross-links DNA during all phases of the cell cycle, resulting in disruption of DNA function, cell cycle arrest, and apoptosis. (NCI04) An antineoplastic agent. It has significant activity against melanomas. (from Martindale, The Extra Pharmacopoeia, 31st ed, p564) Dacarbazine is only found in individuals that have used or taken this drug. It is an antineoplastic agent. It has significant activity against melanomas. (from Martindale, The Extra Pharmacopoeia, 31st ed, p564)The mechanism of action is not known, but appears to exert cytotoxic effects via its action as an alkylating agent. Other theories include DNA synthesis inhibition by its action as a purine analog, and interaction with SH groups. Dacarbazine is not cell cycle-phase specific. L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents

   

azobenzene

azobenzene

C12H10N2 (182.084394)


CONFIDENCE standard compound; INTERNAL_ID 2440

   

(-)-2-Difluoromethylornithine

Women first brand OF eflornithine hydrochloride

C6H12F2N2O2 (182.0866796)


P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01C - Agents against leishmaniasis and trypanosomiasis C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D004791 - Enzyme Inhibitors > D065108 - Ornithine Decarboxylase Inhibitors C471 - Enzyme Inhibitor > C2088 - Ornithine Decarboxylase Inhibitor D000970 - Antineoplastic Agents D - Dermatologicals KEIO_ID H097

   

5-Oxo-1,2-campholide

(1R,5R)-1,8,8-trimethyl-2-oxabicyclo[3.2.1]octane-3,6-dione

C10H14O3 (182.0942894)


   

iridotrial

Iridotrial; (1S,2R,3S)-2-Formyl-alpha-(hydroxymethylene)-3-methylcyclopentaneacetaldehyde

C10H14O3 (182.0942894)


   

Otmcpa

(2,2,3-Trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid

C10H14O3 (182.0942894)


   

(R)-Methylphosphonofluoridic acid 1,2,2-trimethylpropyl ester

(R)-Methylphosphonofluoridic acid 1,2,2-trimethylpropyl ester

C7H16FO2P (182.0871898)


D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D009676 - Noxae > D011042 - Poisons > D002619 - Chemical Warfare Agents D004791 - Enzyme Inhibitors

   

Dihydroconiferyl alcohol

3-(4-hydroxy-3-methoxyphenyl)-propan-1-ol

C10H14O3 (182.0942894)


Dihydroconiferyl alcohol, also known as 3-(4-guaiacyl)propanol or 3-(4-hydroxy-3-methoxyphenyl)-propan-1-ol, is a member of the class of compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Dihydroconiferyl alcohol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Dihydroconiferyl alcohol can be found in lettuce and romaine lettuce, which makes dihydroconiferyl alcohol a potential biomarker for the consumption of these food products. Dihydroconiferyl alcohol is a cell division factor that can be found in pring sap of Acer pseudoplatanus L. Dihydroconiferyl alcohol can stimulate growth of soybean callus[1].

   

Neryl formate

3,7-Dimethyl-2,6-octadienyl ester(e)-formic acid

C11H18O2 (182.1306728)


Food flavouring. Neryl formate is found in lime, lemon, and sweet orange. Neryl formate is found in lemon. Neryl formate is a food flavouring.

   

Decahydro-2-naphthoic acid

Decahydro-2-naphthalenecarboxylic acid

C11H18O2 (182.1306728)


   

1,2-Diphenylethane

1,1-(1,2-Ethanediyl)bis(benzene)

C14H14 (182.1095444)


   

1,2,3-Trimethoxy-5-methylbenzene

1,2,3-Trimethoxy-5-methylbenzene

C10H14O3 (182.0942894)


1,2,3-trimethoxy-5-methylbenzene is a member of the class of compounds known as anisoles. Anisoles are organic compounds containing a methoxybenzene or a derivative thereof. 1,2,3-trimethoxy-5-methylbenzene is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 1,2,3-trimethoxy-5-methylbenzene can be found in safflower and tea, which makes 1,2,3-trimethoxy-5-methylbenzene a potential biomarker for the consumption of these food products.

   

2,4,5-Trimethoxytoluene

1,2,4-trimethoxy-5-methylbenzene

C10H14O3 (182.0942894)


   

(+/-)-Asarinol B

4,5-Epoxy-3-hydroxy-2-caranone

C10H14O3 (182.0942894)


   

Mipafox

bis[(propan-2-yl)amino]phosphinoyl fluoride

C6H16FN2OP (182.09842279999998)


   

Bis(2,3-epoxycyclopentyl)ether

BIS(2,3-EPOXYCYCLOPENTYL) ETHER

C10H14O3 (182.0942894)


   

5,10-dihydrophenazine

5,10-dihydrophenazine

C12H10N2 (182.084394)


A member of the class of phenazines obtained by hydrogenation of the 5 and 10 positions of phenazine.

   

[(R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetic acid

[(R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetic acid

C10H14O3 (182.0942894)


   

Carcinine

Carcinine hydrochloride salt

C8H14N4O (182.1167554)


A beta-alanine derivative that is the amide obtained by formal condensation of the carboxy group of beta-alanine with the primary amino group of histamine.

   

(±)-threo-Anethole glycol

(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


(±)-threo-Anethole glycol is found in fruits. (±)-threo-Anethole glycol is a constituent of Illicium verum (Chinese star anise). Constituent of Illicium verum (Chinese star anise). (±)-threo-Anethole glycol is found in fruits.

   

Linalyl formate

1,6-Octadien-3-ol, 3,7-dimethyl-, 3-formate

C11H18O2 (182.1306728)


Linalyl formate is found in fruits. Linalyl formate is found in oils of lavender, peach, apricot, lime, clary and petitgrain. Linalyl formate is present in Prunus species. Linalyl formate is used in perfumery and food flavourin Linalyl formate is used in perfumery and food flavouring. It is found in oils of lavender, peach, apricot, lime, clary and petitgrain.

   

Methyl geranate

Methyl (2E)-3,7-dimethylocta-2,6-dienoic acid

C11H18O2 (182.1306728)


Methyl_geranate belongs to the family of Acyclic Monoterpenes. These are monoterpenes (compounds made of two consecutive isoprene units) that do not contain a cycle.

   

xi-2-Hexyl-5-methyl-3(2H)-furanone

2-hexyl-5-methyl-2,3-dihydrofuran-3-one

C11H18O2 (182.1306728)


xi-2-Hexyl-5-methyl-3(2H)-furanone is found in onion-family vegetables. xi-2-Hexyl-5-methyl-3(2H)-furanone is a constituent of onions, leeks and shallots.

   

4-Ethyl-2,6-dimethoxyphenol

1-Ethyl-3,5-dimethoxy-4-hydroxybenzene

C10H14O3 (182.0942894)


4-Ethyl-2,6-dimethoxyphenol is a component of smoked food flavourings. Component of smoked food flavourings

   

Methyl (2E,4Z)-decadienoate

Methyl ester(2E,4Z)-2,4-decadienoic acid

C11H18O2 (182.1306728)


Methyl (2E,4Z)-decadienoate is found in fruits. Methyl (2E,4Z)-decadienoate is found in pears and spineless monkey orange. Flavour for candies et Found in pears and spineless monkey orange. Flavour for candies etc

   

4-(Ethoxymethyl)-2-methoxyphenol

Ethyl 4-hydroxy-3-methoxybenzyl ether

C10H14O3 (182.0942894)


4-(Ethoxymethyl)-2-methoxyphenol is a food additive listed in the EAFUS food Additive Database (Jan 2001). Food additive listed in the EAFUS Food Additive Database (Jan 2001)

   

Bornyl formate

1,7,7-Trimethyl-formateendo-bicyclo(2.2.1)heptan-2-ol

C11H18O2 (182.1306728)


Isobornyl formate is a flavouring agent. Flavouring agent

   

Methyl 4,8-decadienoate

Methyl (4Z,8Z)-deca-4,8-dienoic acid

C11H18O2 (182.1306728)


Methyl 4,8-decadienoate is found in alcoholic beverages. Methyl 4,8-decadienoate is a constituent of essential oil of hops (Humulus lupulus) Constituent of essential oil of hops (Humulus lupulus). Methyl 4,8-decadienoate is found in alcoholic beverages and fats and oils.

   

Verimol J

1-(2-Hydroxy-4-methoxyphenyl)-2-propanol

C10H14O3 (182.0942894)


Verimol J is found in fruits. Verimol J is a constituent of Illicium verum (Chinese star anise). Constituent of Illicium verum (Chinese star anise). Verimol J is found in fruits.

   

2,2,7,7-Tetramethyl-1,6-dioxaspiro[4.4]non-3-ene

2,2,7,7-tetramethyl-1,6-dioxaspiro[4.4]non-3-ene

C11H18O2 (182.1306728)


2,2,7,7-Tetramethyl-1,6-dioxaspiro[4.4]non-3-ene is found in alcoholic beverages. 2,2,7,7-Tetramethyl-1,6-dioxaspiro[4.4]non-3-ene is a constituent of hops

   

Tsibulin 2

4-hexylcyclopentane-1,3-dione

C11H18O2 (182.1306728)


Phytoalexin from Allium cepa bulbs (onion) infected with Botrytis cinerea. Tsibulin 2 is found in garden onion and onion-family vegetables. Tsibulin 2 is found in onion-family vegetables. Phytoalexin from Allium cepa bulbs (onion) infected with Botrytis cinerea.

   

Peperinic acid

7a-hydroxy-3,6-dimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-one

C10H14O3 (182.0942894)


Peperinic acid is found in herbs and spices. Peperinic acid is isolated from aged peppermint oil. Isolated from aged peppermint oil. Peperinic acid is found in herbs and spices.

   

Amyl 2-furoate

2-Furancarboxylic acid, pentyl ester (9ci)

C10H14O3 (182.0942894)


Amyl 2-furoate is used in food flavourin

   

alpha-Terpineol formate

3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, formate

C11H18O2 (182.1306728)


alpha-Terpineol formate is found in cardamom. alpha-Terpineol formate is a flavouring agent Flavouring agent. alpha-Terpinyl formate is found in cardamom and sweet bay.

   

5-Pentyl-3h-furan-2-one

(5E)-3,4-Dimethyl-5-pentylidene-oxolan-2-one

C11H18O2 (182.1306728)


5-Pentyl-3h-furan-2-one is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

4-Hydroxy-4-methyl-7-decenoic acid gamma-lactone

5-(3Z)-3-Hexen-1-yldihydro-5-methyl-2(3H)-furanone

C11H18O2 (182.1306728)


4-Hydroxy-4-methyl-7-decenoic acid gamma-lactone is a flavouring agent for baked goods, candies and meat product Flavouring agent for baked goods, candies and meat products [DFC]

   

Ethyl octynecarboxylate

Carbonic acid, ethyl octynyl ester

C11H18O2 (182.1306728)


Ethyl octynecarboxylate is a flavouring ingredient. Flavouring ingredient

   

Furfuryl pentanoate

Pentanoic acid, 2-furanylmethyl ester

C10H14O3 (182.0942894)


Furfuryl pentanoate is a flavouring ingredient. Flavouring ingredient

   

6-(3-Hexenyl)tetrahydro-2H-pyran-2-one

6-(3-Hexenyl)tetrahydro-2H-pyran-2-one, 9ci, 8ci

C11H18O2 (182.1306728)


6-(3-Hexenyl)tetrahydro-2H-pyran-2-one is a flavouring ingredient. Flavouring ingredient

   

(3E,6Z)-Nonadien-1-yl acetate

(3E,6Z)-Nona-3,6-dien-1-yl acetic acid

C11H18O2 (182.1306728)


(3E,6Z)-Nonadien-1-yl acetate is a food flavour.

   

(2E,6Z)-2,6-Nonadien-1-Yl acetate

(2Z,6Z)-Nona-2,6-dien-1-yl acetic acid

C11H18O2 (182.1306728)


(2E,6Z)-2,6-Nonadien-1-Yl acetate is a flavouring ingredient. Flavouring ingredient

   

cis-3-Hexenyl tiglate

2-Methyl-(3Z)-3-hexen-1-yl ester(2E)-2-butenoic acid

C11H18O2 (182.1306728)


cis-3-Hexenyl tiglate is a flavouring ingredient. Flavouring ingredient

   

2-Ethoxy-4-(methoxymethyl)phenol

2-Ethoxy-4-(methoxymethyl)phenol, 9ci

C10H14O3 (182.0942894)


2-Ethoxy-4-(methoxymethyl)phenol is a fragrance ingredient with a vanilla odour. Fragrance ingredient with a vanilla odour

   

Furfuryl isovalerate

Butanoic acid, 3-methyl-, 2-furanylmethyl ester

C10H14O3 (182.0942894)


Furfuryl isovalerate is found in coffee and coffee products. Furfuryl isovalerate is a flavouring ingredient. Furfuryl isovalerate is a constituent of coffee aroma. Flavouring ingredient. Constituent of coffee aroma. Furfuryl isovalerate is found in coffee and coffee products.

   

Allyl cyclohexylacetate

Prop-2-en-1-yl 2-cyclohexylacetic acid

C11H18O2 (182.1306728)


Allyl cyclohexylacetate is a flavouring ingredient. Flavouring ingredient

   

Isoamyl 2-furoate

3-Methylbutyl furan-2-carboxylic acid

C10H14O3 (182.0942894)


Isoamyl 2-furoate belongs to the family of Furoic Acid Derivatives. These are organic compounds containing a furoic acid moiety, whose structure is characterized by a furan ring bearing a carboxylic acid group at the C2 or C3 carbon atom.

   

4-Azaspiro[bicyclo[2.2.2]octane-2,2'-[1,4]oxazolidine]-5'-one

4-Azaspiro[bicyclo[2.2.2]octane-2,2-[1,4]oxazolidine]-5-one

C9H14N2O2 (182.1055224)


   

N(2),N(2),N(4),N(6)-Tetramethylmelamine

N(2),N(2),N(4),N(6)-Tetramethylmelamine monohydrochloride

C7H14N6 (182.1279884)


   

5,6-Dihydro-1,10-phenanthroline

1,10-Phenanthroline monohydrochoride

C12H10N2 (182.084394)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D003432 - Cross-Linking Reagents D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D007364 - Intercalating Agents D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors

   

(S)-3-(2-Methylphenoxy)propane-1,2-diol

Sanofi synthelabo otc brand OF mephenesin

C10H14O3 (182.0942894)


M - Musculo-skeletal system > M03 - Muscle relaxants > M03B - Muscle relaxants, centrally acting agents D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents C78281 - Agent Affecting Musculoskeletal System > C29696 - Muscle Relaxant D002491 - Central Nervous System Agents Mephenesin is an NMDA receptor antagonist and Mephenesin is a central muscle relaxant.

   

Alaptide

8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C9H14N2O2 (182.1055224)


   

Azobenzene

(e)-1,2-Diphenyldiazene

C12H10N2 (182.084394)


   

Carcinine

3-amino-N-[2-(3H-imidazol-4-yl)ethyl]propanamide

C8H14N4O (182.1167554)


   

3-(2-Azetidinylmethoxy)-2-fluoropyridine

2-(18)F-Fluoro-3(2(S)-2-azetidinylmethoxy)pyridine

C9H11FN2O (182.0855368)


   

DL-Difluoromethylornithine

5-amino-2-[(difluoromethyl)amino]pentanoic acid

C6H12F2N2O2 (182.0866796)


   

pyrrolo[2,1-c][1,4]benzodiazepine

3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1,5,7,9,11,13-hexaene

C12H10N2 (182.084394)


   

Difluoromethyl (2R)-2,5-diaminopentanoate

Difluoromethyl (2R)-2,5-diaminopentanoic acid

C6H12F2N2O2 (182.0866796)


   

Dimethyltriazenoimidazole carboxamide

4-(3,3-dimethyltriaz-1-en-1-yl)-3H-imidazole-2-carboxamide

C6H10N6O (182.09160500000002)


   

tetramethylmelamine

N2,N2,N4,N4-tetramethyl-1,3,5-triazine-2,4,6-triamine

C7H14N6 (182.1279884)


   

(±)-erythro-Anethole glycol

1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


Constituent of Illicium verum (Chinese star anise). (±)-erythro-Anethole glycol is found in fruits.

   

methyl-(E)-geranate

Methyl 3,7-dimethylocta-2,6-dienoic acid

C11H18O2 (182.1306728)


Flavouring compound [Flavornet]

   

HUP8L9D9RF

2-Butenoic acid,2-methyl-, anhydride, (2Z,2'Z)-

C10H14O3 (182.0942894)


   
   

Santolinic acid methyl ester

Santolinic acid methyl ester

C11H18O2 (182.1306728)


   
   

n-(hexahydro-1h-1,6-epoxypyrrolizin-7-yl)-n-methylformamide

n-(hexahydro-1h-1,6-epoxypyrrolizin-7-yl)-n-methylformamide

C9H14N2O2 (182.1055224)


   
   
   

p-Mentha-1,3,5-triene-3,8,9-triol

p-Mentha-1,3,5-triene-3,8,9-triol

C10H14O3 (182.0942894)


   
   
   

Modiolide B

4R-hydroxy-2Z,5E-decadien-9R-olide

C10H14O3 (182.0942894)


   
   

4-Hydroxy-6-isopropyl-3,5-dimethyl-2H-pyran-2-one

4-Hydroxy-6-isopropyl-3,5-dimethyl-2H-pyran-2-one

C10H14O3 (182.0942894)


   

Myodesertin

1-Methoxy-3-myodesertene

C11H18O2 (182.1306728)


   
   
   
   
   

9,10-Dihydroxythymol

2-(2Hydroxy-4-methylphenyl)-1,3-propanediol

C10H14O3 (182.0942894)


   

Chrysanthemyl acetate

Chrysanthemyl acetate

C11H18O2 (182.1306728)


   

1-Acetoxy-3,6-nonadiene

1-Acetoxy-3,6-nonadiene

C11H18O2 (182.1306728)


   

xi-2-Hexyl-5-methyl-3(2H)-furanone

2-hexyl-5-methyl-2,3-dihydrofuran-3-one

C11H18O2 (182.1306728)


Xi-2-hexyl-5-methyl-3(2h)-furanone is a member of the class of compounds known as furanones. Furanones are compounds containing a furan ring bearing a ketone group. Xi-2-hexyl-5-methyl-3(2h)-furanone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Xi-2-hexyl-5-methyl-3(2h)-furanone can be found in onion-family vegetables, which makes xi-2-hexyl-5-methyl-3(2h)-furanone a potential biomarker for the consumption of this food product. xi-2-Hexyl-5-methyl-3(2H)-furanone is found in onion-family vegetables. xi-2-Hexyl-5-methyl-3(2H)-furanone is a constituent of onions, leeks and shallots.

   

5,8-Epoxy-2-methoxy-o-menth-1(6)-ene

5,8-Epoxy-2-methoxy-o-menth-1(6)-ene

C11H18O2 (182.1306728)


   
   

5,6-Dihydro-6-(4-oxopentyl)-2H-pyran-2-one

5,6-Dihydro-6-(4-oxopentyl)-2H-pyran-2-one

C10H14O3 (182.0942894)


   
   

Methyl santolinate

Methyl santolinate

C11H18O2 (182.1306728)


   
   

3,4-Dimethoxyphenethyl alcohol

3,4-Dimethoxyphenethyl alcohol

C10H14O3 (182.0942894)


   
   

4,4-DIMETHYLBIPHENYL

4,4-DIMETHYLBIPHENYL

C14H14 (182.1095444)


   
   
   

1,7-Dimethyl-3-oxo-norbornan-7-carbonsaeure|1,7-dimethyl-3-oxo-norbornane-7-carboxylic acid

1,7-Dimethyl-3-oxo-norbornan-7-carbonsaeure|1,7-dimethyl-3-oxo-norbornane-7-carboxylic acid

C10H14O3 (182.0942894)


   
   

2,6-dimethylhepta-1,5-dien-3-yl acetate

2,6-dimethylhepta-1,5-dien-3-yl acetate

C11H18O2 (182.1306728)


   
   

(+-)-5-Oxo-2-isopropyl-cyclohexen-(6)-carbonsaeure-(1)|2-Isopropyl-cyclohexen-(6)-on-(5)-carbonsaeure-(1)|2-Methoaethyl-cyclohexen-(6)-on-(5)-carbonsaeure-(1)|5-oxo-o-menth-6-en-7-oic acid|5-Oxo-o-menth-6-en-7-saeure

(+-)-5-Oxo-2-isopropyl-cyclohexen-(6)-carbonsaeure-(1)|2-Isopropyl-cyclohexen-(6)-on-(5)-carbonsaeure-(1)|2-Methoaethyl-cyclohexen-(6)-on-(5)-carbonsaeure-(1)|5-oxo-o-menth-6-en-7-oic acid|5-Oxo-o-menth-6-en-7-saeure

C10H14O3 (182.0942894)


   
   

3-[(2E)-4-hydroxy-4-methylpent-2-en-1-yl]furan-2(5H)-one|sibiscolactone

3-[(2E)-4-hydroxy-4-methylpent-2-en-1-yl]furan-2(5H)-one|sibiscolactone

C10H14O3 (182.0942894)


   

5-(3-Hydroxypropyl)-2-methoxyphenol

5-(3-Hydroxypropyl)-2-methoxyphenol

C10H14O3 (182.0942894)


   

p-Anisaldehyde dimethyl acetal

p-Anisaldehyde dimethyl acetal

C10H14O3 (182.0942894)


   

2-methoxy-6-propylbenzene-1,4-diol

2-methoxy-6-propylbenzene-1,4-diol

C10H14O3 (182.0942894)


   

2,3-Dimethyl-2-nonen-4-olide

2,3-Dimethyl-2-nonen-4-olide

C11H18O2 (182.1306728)


   

4-(3-Hydroxybutyl)benzene-1,2-diol

4-(3-Hydroxybutyl)benzene-1,2-diol

C10H14O3 (182.0942894)


   

2,4,6-Trimethoxytoluene

2,4,6-Trimethoxytoluene

C10H14O3 (182.0942894)


   

(3R,5S,7S,8S,9S)-3,8-epoxy-7-hydroxy-Delta4,11-dihyronepetane|jatamanin C

(3R,5S,7S,8S,9S)-3,8-epoxy-7-hydroxy-Delta4,11-dihyronepetane|jatamanin C

C10H14O3 (182.0942894)


   

Paeoniisothujone|paeonisothujone

Paeoniisothujone|paeonisothujone

C10H14O3 (182.0942894)


   
   

5,10-dihydro-benzo[b][1,7]naphthyridine|beta-Carbolin|Harman

5,10-dihydro-benzo[b][1,7]naphthyridine|beta-Carbolin|Harman

C12H10N2 (182.084394)


   

1-(4-Hydroxyphenyl)-1-methoxy-2-propanol

1-(4-Hydroxyphenyl)-1-methoxy-2-propanol

C10H14O3 (182.0942894)


   

3,4-Dimethylbiphenyl

3,4-Dimethylbiphenyl

C14H14 (182.1095444)


   

2-(hydroxymethyl)-5-methoxy-3,6-dimethylphenol

2-(hydroxymethyl)-5-methoxy-3,6-dimethylphenol

C10H14O3 (182.0942894)


   

(5E,7E)-9-oxodeca-5,7-dienoic acid

(5E,7E)-9-oxodeca-5,7-dienoic acid

C10H14O3 (182.0942894)


   

3-(1-hydroxybutyl)-2,4-dimethylcyclopent-2-enone|phomotenone

3-(1-hydroxybutyl)-2,4-dimethylcyclopent-2-enone|phomotenone

C11H18O2 (182.1306728)


   

1-(4-hydroxyphenyl)butane-2,3-diol

1-(4-hydroxyphenyl)butane-2,3-diol

C10H14O3 (182.0942894)


   

(+)-methyl 4-acetylcyclohex-1-ene-1-carboxylate

(+)-methyl 4-acetylcyclohex-1-ene-1-carboxylate

C10H14O3 (182.0942894)


   

(7S)-p-cymene-2,7,8-triol

(7S)-p-cymene-2,7,8-triol

C10H14O3 (182.0942894)


   
   
   

4-(2-hydroxypropan-2-yl)cyclohexa-1,3-diene-1-carboxylic acid

4-(2-hydroxypropan-2-yl)cyclohexa-1,3-diene-1-carboxylic acid

C10H14O3 (182.0942894)


   
   
   

1,2,3,4-Tetrahydroanthracene

1,2,3,4-Tetrahydroanthracene

C14H14 (182.1095444)


   
   

Methyl chrysanthemate

Methyl chrysanthemate

C11H18O2 (182.1306728)


   
   

Tetrahydroactinidiolide

Tetrahydroactinidiolide

C11H18O2 (182.1306728)


   

(3S,6E)-3,7-dimethyl-nona-6,8-dienoic acid

(3S,6E)-3,7-dimethyl-nona-6,8-dienoic acid

C11H18O2 (182.1306728)


   

(+)-Diplodiaalide A|Diplodialid-A|Diplodialide A

(+)-Diplodiaalide A|Diplodialid-A|Diplodialide A

C10H14O3 (182.0942894)


   

KFKGGMRELGBRAF-UHFFFAOYSA-

KFKGGMRELGBRAF-UHFFFAOYSA-

C10H14O3 (182.0942894)


   
   
   
   

1-(4-Hydroxy-3-methoxyphenyl)-2-propanol

1-(4-Hydroxy-3-methoxyphenyl)-2-propanol

C10H14O3 (182.0942894)


   

6-(4-Hydroxypentyl)-2H-pyran-2-one

6-(4-Hydroxypentyl)-2H-pyran-2-one

C10H14O3 (182.0942894)


   
   

methyl 5-isopropyl-2-methylcyclopentenecarboxylate

methyl 5-isopropyl-2-methylcyclopentenecarboxylate

C11H18O2 (182.1306728)


   

2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione

2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione

C10H14O3 (182.0942894)


   

p-Mentha-1,3,5-triene-3,9,10-triol

p-Mentha-1,3,5-triene-3,9,10-triol

C10H14O3 (182.0942894)


   
   

trans-alpha-necrodyl acetate

trans-alpha-necrodyl acetate

C11H18O2 (182.1306728)


   

(3S,8S)-(-)-4,6-decadiyne-1,3,8-triol|4,6-decadiyne-1,3,8-triol|4,6-Decadiyne-1,3,8-triol-(3S,8S)-form

(3S,8S)-(-)-4,6-decadiyne-1,3,8-triol|4,6-decadiyne-1,3,8-triol|4,6-Decadiyne-1,3,8-triol-(3S,8S)-form

C10H14O3 (182.0942894)


   

Dec-9-insaeure-methylester|dec-9-ynoic acid methyl ester|methyl 9-decynoate|Methyl dec-9-ynoate|methyl decinoate|methyl-9-decynoate

Dec-9-insaeure-methylester|dec-9-ynoic acid methyl ester|methyl 9-decynoate|Methyl dec-9-ynoate|methyl decinoate|methyl-9-decynoate

C11H18O2 (182.1306728)


   

8-acetyl-2,7-octadienoic acid

8-acetyl-2,7-octadienoic acid

C10H14O3 (182.0942894)


   
   

(5R,9R)-3,9-epoxy-10-hydroxy-Delta4,11,7,8dihyronepeta-1-ol|jatamanin K

(5R,9R)-3,9-epoxy-10-hydroxy-Delta4,11,7,8dihyronepeta-1-ol|jatamanin K

C10H14O3 (182.0942894)


   

7,7-Dimethylbicyclo[2.2.1]hept-2-yl acetate #

7,7-Dimethylbicyclo[2.2.1]hept-2-yl acetate #

C11H18O2 (182.1306728)


   

7-Methyl-1,6-octadiene-3-ol acetate

7-Methyl-1,6-octadiene-3-ol acetate

C11H18O2 (182.1306728)


   

2,3,5-Trimethoxytoluene

2,3,5-Trimethoxytoluene

C10H14O3 (182.0942894)


   

(1R,4R)-4-methoxy-3,3,5-trimethyl-2-oxabicyclo[2.2.2]oct-5-ene

(1R,4R)-4-methoxy-3,3,5-trimethyl-2-oxabicyclo[2.2.2]oct-5-ene

C11H18O2 (182.1306728)


   

4-(4-Methyl-3-pentenyl)-5-hydroxyfuran-2(5H)-one

4-(4-Methyl-3-pentenyl)-5-hydroxyfuran-2(5H)-one

C10H14O3 (182.0942894)


   

3-Ethyl-4-hydroxy-6-propyl-2H-pyran-2-one

3-Ethyl-4-hydroxy-6-propyl-2H-pyran-2-one

C10H14O3 (182.0942894)


   

2,2,4,4-tetramethylcyclohexane-1,3,5-trione

2,2,4,4-tetramethylcyclohexane-1,3,5-trione

C10H14O3 (182.0942894)


   

Pyridine, (1,2-ethenediyl)bis-

Pyridine, (1,2-ethenediyl)bis-

C12H10N2 (182.084394)


   

4-hydroxy-6-pentylpyran-2-one

4-hydroxy-6-pentylpyran-2-one

C10H14O3 (182.0942894)


A pyranone that is 2H-pyran-2-one in which the hydrogens at positions 4 and 6 are substituted by hydroxy and pentyl groups respectively.

   

guaiacyl propanol

3-(4-Hydroxy-3-methoxyphenyl)-1-propanol;Dihydroconiferyl Alcohol

C10H14O3 (182.0942894)


Dihydroconiferyl alcohol is a member of class of phenols that is 2-methoxyphenol substituted by a 3-hydroxypropyl group at position 4. It has a role as a plant metabolite. It is a primary alcohol and a eugenol. Dihydroconiferyl alcohol is a natural product found in Euterpe oleracea, Broussonetia papyrifera, and other organisms with data available. See also: Acai fruit pulp (part of). A member of class of phenols that is 2-methoxyphenol substituted by a 3-hydroxypropyl group at position 4. Dihydroconiferyl alcohol is a cell division factor that can be found in pring sap of Acer pseudoplatanus L. Dihydroconiferyl alcohol can stimulate growth of soybean callus[1].

   

Harman

Harmane

C12H10N2 (182.084394)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.504 D009676 - Noxae > D009498 - Neurotoxins D009676 - Noxae > D009153 - Mutagens relative retention time with respect to 9-anthracene Carboxylic Acid is 0.500 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.495 IPB_RECORD: 461; CONFIDENCE confident structure Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4]. Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4]. Harmane, a β-Carboline alkaloid (BCA), is a potent neurotoxin that causes severe action tremors and psychiatric manifestations. Harmane shows 1000-fold selectivity for I1-Imidazoline receptor (IC50=30 nM) over α2-adrenoceptor (IC50=18 μM). Harmane is also a potent and selective inhibitor of monoamine oxidase (MAO) (IC50s=0.5 and 5 μM for human MAO A/B, respectively). Harmane exhibits comutagenic effect[1][2][3][4].

   

Harmane

Harmane

C12H10N2 (182.084394)


Annotation level-1 Acquisition and generation of the data is financially supported by the Max-Planck-Society IPB_RECORD: 2281; CONFIDENCE confident structure IPB_RECORD: 2961; CONFIDENCE confident structure

   
   

1-(4-methoxyphenyl)propane-1,2-diol

NCGC00385847-01!1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


   

1-(4-methoxyphenyl)propane-1,2-diol

1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


   
   
   

3-Carboxy-2,4,4-trimethyl-2-cyclohexenone

3-Carboxy-2,4,4-trimethyl-2-cyclohexenone

C10H14O3 (182.0942894)


   

Methyl geranate

(E)-methyl geranate

C11H18O2 (182.1306728)


   

2E,4E-undecadienoic acid

2E,4E-undecadienoic acid

C11H18O2 (182.1306728)


   

5-oxo-7-decynoic acid

7-Decynoic acid, 5-oxo-

C10H14O3 (182.0942894)


   

9-Undecynoic acid

9-Hendecynoic acid

C11H18O2 (182.1306728)


   

10-Undecynoic acid

10-Undecynoic acid

C11H18O2 (182.1306728)


   

Mephenesin

Mephenesin

C10H14O3 (182.0942894)


M - Musculo-skeletal system > M03 - Muscle relaxants > M03B - Muscle relaxants, centrally acting agents D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents C78281 - Agent Affecting Musculoskeletal System > C29696 - Muscle Relaxant D002491 - Central Nervous System Agents Mephenesin is an NMDA receptor antagonist and Mephenesin is a central muscle relaxant.

   

C11:2n-7,9

2E,4E-undecadienoic acid

C11H18O2 (182.1306728)


   

2-undecynoic acid

2-undecynoic acid

C11H18O2 (182.1306728)


   

3-undecynoic acid

3-undecynoic acid

C11H18O2 (182.1306728)


   

4-undecynoic acid

4-undecynoic acid

C11H18O2 (182.1306728)


   

5-undecynoic acid

5-undecynoic acid

C11H18O2 (182.1306728)


   

6-undecynoic acid

6-undecynoic acid

C11H18O2 (182.1306728)


   

7-undecynoic acid

7-undecynoic acid

C11H18O2 (182.1306728)


   

8-undecynoic acid

8-undecynoic acid

C11H18O2 (182.1306728)


   

10-oxo-5,8-decadienoic acid

10-oxo-5,8-decadienoic acid

C10H14O3 (182.0942894)


   

Amyl furoate

2-Furancarboxylic acid, pentyl ester (9ci)

C10H14O3 (182.0942894)


   

2,2,7,7-tetramethyl-1,6-dioxaspiro[4.4]non-3-ene

2,2,7,7-tetramethyl-1,6-dioxaspiro[4.4]non-3-ene

C11H18O2 (182.1306728)


   

Linalyl formate

1,6-Octadien-3-ol, 3,7-dimethyl-, 3-formate

C11H18O2 (182.1306728)


   

Terpinyl formate

3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, formate

C11H18O2 (182.1306728)


   

5-pentyl-3H-furan-2-one

(5E)-3,4-Dimethyl-5-pentylidene-oxolan-2-one

C11H18O2 (182.1306728)


   

Anethole glycol

1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


   

Ethylsyringol

1-Ethyl-3,5-dimethoxy-4-hydroxybenzene

C10H14O3 (182.0942894)


   

Omaflora

methyl (4Z,8Z)-deca-4,8-dienoate

C11H18O2 (182.1306728)


   

FEMA 3859

Methyl ester(2E,4Z)-2,4-decadienoic acid

C11H18O2 (182.1306728)


   

FEMA 3937

5-(3Z)-3-Hexen-1-yldihydro-5-methyl-2(3H)-furanone

C11H18O2 (182.1306728)


   

Ethyl nonynoate

Carbonic acid, ethyl octynyl ester

C11H18O2 (182.1306728)


   

Verimol J

1-(2-Hydroxy-4-methoxyphenyl)-2-propanol

C10H14O3 (182.0942894)


   

Tsibulin 2

4-hexylcyclopentane-1,3-dione

C11H18O2 (182.1306728)


   

Vanillyl ethyl ether

Ethyl 4-hydroxy-3-methoxybenzyl ether

C10H14O3 (182.0942894)


   

Furfuryl valerate

Pentanoic acid, 2-furanylmethyl ester

C10H14O3 (182.0942894)


   

jasmolactone

6-(3-Hexenyl)tetrahydro-2H-pyran-2-one, 9ci, 8ci

C11H18O2 (182.1306728)


   

xi-2-Hexyl-5-methyl-3(2H)-furanone

2-hexyl-5-methyl-2,3-dihydrofuran-3-one

C11H18O2 (182.1306728)


   

FEMA 3953

(3E,6Z)-nona-3,6-dien-1-yl acetate

C11H18O2 (182.1306728)


   

Nonadienyl acetate

(2Z,6Z)-nona-2,6-dien-1-yl acetate

C11H18O2 (182.1306728)


   

Peperinic acid

7a-hydroxy-3,6-dimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-one

C10H14O3 (182.0942894)


   

Bornyl formate

1,7,7-Trimethyl-formateendo-bicyclo(2.2.1)heptan-2-ol

C11H18O2 (182.1306728)


   

FEMA 3931

2-Methyl-(3Z)-3-hexen-1-yl ester(2E)-2-butenoic acid

C11H18O2 (182.1306728)


   

dianthus ethone

2-Ethoxy-4-(methoxymethyl)phenol, 9ci

C10H14O3 (182.0942894)


   

Furfuryl isovalerate

Butanoic acid, 3-methyl-, 2-furanylmethyl ester

C10H14O3 (182.0942894)


   

a-Tda

prop-2-en-1-yl 2-cyclohexylacetate

C11H18O2 (182.1306728)


   

1,2-Di(2-pyridyl)ethylene

Pyridine,2,2-(1,2-ethenediyl)bis-

C12H10N2 (182.084394)


   

formyl 2E,4E-decadienoate

formyl 2E,4E-decadienoate

C11H18O2 (182.1306728)


   

WE(6:1(2E)/4:1(2E)(2Me))

(E)-2-Hexenyl 2-methyl-(E)-2-butenoate

C11H18O2 (182.1306728)


   

WE(8:2(2Z,6E)(3Me,7Me)/1:0)

(Z)-3,7-Dimethyl-2,6-octadienyl formate

C11H18O2 (182.1306728)


   

FA 11:2

2,4,7-trimethyl-2E,4E-octadienoic acid

C11H18O2 (182.1306728)


   

FA 10:3;O

6-oxo-2E,4E-decadienoic acid

C10H14O3 (182.0942894)


   

WE 11:2

(3Z)-hex-3-en-1-yl (2E)-2-methylbut-2-enoate

C11H18O2 (182.1306728)


   

WE 10:3;O

furan-2-ylmethyl 3-methylbutanoate

C10H14O3 (182.0942894)


   

SFE 11:2

(Z)-3,7-Dimethyl-2,6-octadienyl formate

C11H18O2 (182.1306728)


   

2-Oxaspiro[4.6]undecane-1,3-dione

2-Oxaspiro[4.6]undecane-1,3-dione

C10H14O3 (182.0942894)


   

4-methyl-9H-pyrido[3,4-b]indole

4-methyl-9H-pyrido[3,4-b]indole

C12H10N2 (182.084394)


   

Methyl 3-isobutyl-1H-pyrazole-5-carboxylate

Methyl 3-isobutyl-1H-pyrazole-5-carboxylate

C9H14N2O2 (182.1055224)


   

2-Hydroxyethyl 5-norbornene-2-carboxylate

2-Hydroxyethyl 5-norbornene-2-carboxylate

C10H14O3 (182.0942894)


   

Pyridazine,4-(2-phenylethenyl)-

Pyridazine,4-(2-phenylethenyl)-

C12H10N2 (182.084394)


   

9H-carbazol-3-amine

9H-carbazol-3-amine

C12H10N2 (182.084394)


   
   

Methyl 3-(tert-butyl)-1H-pyrazole-4-carboxylate

Methyl 3-(tert-butyl)-1H-pyrazole-4-carboxylate

C9H14N2O2 (182.1055224)


   

1,1-Diphenylethane

1,1-Diphenylethane

C14H14 (182.1095444)


   

2-N-butyl-1,3,5-triazine-2,4,6-triamine

2-N-butyl-1,3,5-triazine-2,4,6-triamine

C7H14N6 (182.1279884)


   

4,4-Vinylenedipyridine

Pyridine,4,4-(1,2-ethenediyl)bis-

C12H10N2 (182.084394)


   

5-amino-1-tert-butylpyrazole-4-carboxamide

5-amino-1-tert-butylpyrazole-4-carboxamide

C8H14N4O (182.1167554)


   

2,3-DIMETHOXY-BENZYL-HYDRAZINE

2,3-DIMETHOXY-BENZYL-HYDRAZINE

C9H14N2O2 (182.1055224)


   

1,3-dimethyl-5-phenylbenzene

1,3-dimethyl-5-phenylbenzene

C14H14 (182.1095444)


   

ETHYL 3-AMINO-1-ETHYL-1H-PYRROLE-2-CARBOXYLATE

ETHYL 3-AMINO-1-ETHYL-1H-PYRROLE-2-CARBOXYLATE

C9H14N2O2 (182.1055224)


   

(+/-)-cis-6-Hydroxy-1-Methylbicyclo[4.3.0]nonane-2,7-dione

(+/-)-cis-6-Hydroxy-1-Methylbicyclo[4.3.0]nonane-2,7-dione

C10H14O3 (182.0942894)


   

3-methyl-5H-pyrido[4,3-b]indole

3-methyl-5H-pyrido[4,3-b]indole

C12H10N2 (182.084394)


   
   

hex-2-enylsuccinic anhydride

hex-2-enylsuccinic anhydride

C10H14O3 (182.0942894)


   

3-(Hydroxymethyl)-1-adamantol

3-(Hydroxymethyl)-1-adamantol

C11H18O2 (182.1306728)


   

1-(4-METHYLPHENYL)-1H-PYRROLE-2-CARBONITRILE

1-(4-METHYLPHENYL)-1H-PYRROLE-2-CARBONITRILE

C12H10N2 (182.084394)


   

1,6,8-trioxa-dispiro[4.1.4.2]tridec-12-ene

1,6,8-trioxa-dispiro[4.1.4.2]tridec-12-ene

C10H14O3 (182.0942894)


   

4-amino-1-methyl-5-propylpyrazole-3-carboxamide

4-amino-1-methyl-5-propylpyrazole-3-carboxamide

C8H14N4O (182.1167554)


   

2-hexen-1-ylsuccinic anhydride

2-hexen-1-ylsuccinic anhydride

C10H14O3 (182.0942894)


   

4-chloropentylbenzene

4-chloropentylbenzene

C11H15Cl (182.086222)


   

p-tert-butylbenzyl chloride

p-tert-butylbenzyl chloride

C11H15Cl (182.086222)


   

1-(1-tert-butyl-4-hydroxy-1H-pyrazol-3-yl)ethanone

1-(1-tert-butyl-4-hydroxy-1H-pyrazol-3-yl)ethanone

C9H14N2O2 (182.1055224)


   

2,4(1H,3H)-Pyrimidinedione,6-methyl-3-(1-methylpropyl)-

2,4(1H,3H)-Pyrimidinedione,6-methyl-3-(1-methylpropyl)-

C9H14N2O2 (182.1055224)


   

(phenylethyl)benzene

(phenylethyl)benzene

C14H14 (182.1095444)


   

2-Acetyl-5,5-dimethyl-1,3-cyclohexanedione

2-Acetyl-5,5-dimethyl-1,3-cyclohexanedione

C10H14O3 (182.0942894)


   

Trimethyl orthobenzoate

Trimethyl orthobenzoate

C10H14O3 (182.0942894)


   

Ethyl 6-methyl-2-oxo-3-cyclohexene-1-carboxylate

Ethyl 6-methyl-2-oxo-3-cyclohexene-1-carboxylate

C10H14O3 (182.0942894)


   

Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, methyl ester

Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, methyl ester

C11H18O2 (182.1306728)


   

1-(2-Pyridyl)-2(3-pyridly)ethylene

1-(2-Pyridyl)-2(3-pyridly)ethylene

C12H10N2 (182.084394)


   

DIMETHYLBIPHENYL

DIMETHYLBIPHENYL

C14H14 (182.1095444)


   

1-(TERT-BUTYL)-5-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

1-(TERT-BUTYL)-5-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

C9H14N2O2 (182.1055224)


   

2-(HYDROXYMETHYL)-2-PHENYLPROPANE-1,3-DIOL

2-(HYDROXYMETHYL)-2-PHENYLPROPANE-1,3-DIOL

C10H14O3 (182.0942894)


   

RARECHEM AL BZ 0074

RARECHEM AL BZ 0074

C9H11FN2O (182.0855368)


   

(2,6-dimethoxy-4-methylphenyl)methanol

(2,6-dimethoxy-4-methylphenyl)methanol

C10H14O3 (182.0942894)


   

3-(tert-Butyl)-1-methyl-1H-pyrazole-5-carboxylic acid

3-(tert-Butyl)-1-methyl-1H-pyrazole-5-carboxylic acid

C9H14N2O2 (182.1055224)


   

4-AMINO-6-(TERT-BUTYL)-1-METHYL-1,2-DIHYDRO-1,3,5-TRIAZIN-2-ONE

4-AMINO-6-(TERT-BUTYL)-1-METHYL-1,2-DIHYDRO-1,3,5-TRIAZIN-2-ONE

C8H14N4O (182.1167554)


   

4-(Hydroxymethyl)benzaldehyde dimethyl acetal

4-(Hydroxymethyl)benzaldehyde dimethyl acetal

C10H14O3 (182.0942894)


   
   

2-Thiazolamine,4-cyclohexyl-

2-Thiazolamine,4-cyclohexyl-

C9H14N2S (182.0877644)


   
   

1-(4-Methoxyphenoxy)-2-propanol

1-(4-Methoxyphenoxy)-2-propanol

C10H14O3 (182.0942894)


   

4-ACETAMINO-4?-NITRODIPHENYLSULFONE-2?-SULFONAMIDE

4-ACETAMINO-4?-NITRODIPHENYLSULFONE-2?-SULFONAMIDE

C9H11FN2O (182.0855368)


   

(3-Ethoxy-4-methoxyphenyl)methanol

(3-Ethoxy-4-methoxyphenyl)methanol

C10H14O3 (182.0942894)


   

2-ISOPROPOXY-3-METHOXYPHENOL

2-ISOPROPOXY-3-METHOXYPHENOL

C10H14O3 (182.0942894)


   

(E)-N-Phenyl-1-(2-pyridinyl)methanimine

(E)-N-Phenyl-1-(2-pyridinyl)methanimine

C12H10N2 (182.084394)


   

2-Heptylthiophene

2-(N-HEPTYL)THIOPHENE

C11H18S (182.1129148)


   

Hydroconiferyl Alcohol

Hydroconiferyl Alcohol

C10H14O3 (182.0942894)


   

3-Oxabicyclo[3.2.1]octane-2,4-dione,1,8,8-trimethyl-, (1R,5S)-

3-Oxabicyclo[3.2.1]octane-2,4-dione,1,8,8-trimethyl-, (1R,5S)-

C10H14O3 (182.0942894)


   

2-(5,6-dimethoxypyridin-2-yl)ethanamine

2-(5,6-dimethoxypyridin-2-yl)ethanamine

C9H14N2O2 (182.1055224)


   
   

1H-Pyrrole-2,5-dione, 1-(5-aminopentyl)-

1H-Pyrrole-2,5-dione, 1-(5-aminopentyl)-

C9H14N2O2 (182.1055224)


   

9H-Carbazol-9-amine

9H-Carbazol-9-amine

C12H10N2 (182.084394)


   

Benzenemethanol,2-(dimethoxymethyl)-

Benzenemethanol,2-(dimethoxymethyl)-

C10H14O3 (182.0942894)


   

N-CYANO-N-[(TETRAHYDROFURAN-2-YL)METHYL]-N-METHYLGUANIDINE

N-CYANO-N-[(TETRAHYDROFURAN-2-YL)METHYL]-N-METHYLGUANIDINE

C8H14N4O (182.1167554)


   

1-(Dimethoxymethyl)-4-methoxybenzene

1-(Dimethoxymethyl)-4-methoxybenzene

C10H14O3 (182.0942894)


   

[4-(Trifluoromethyl)cyclohexyl]methanol

[4-(Trifluoromethyl)cyclohexyl]methanol

C8H13F3O (182.09184439999999)


   

3,5-DIMETHOXY-BENZYL-HYDRAZINE

3,5-DIMETHOXY-BENZYL-HYDRAZINE

C9H14N2O2 (182.1055224)


   

5-TERT-BUTYLPYROGALLOL

5-TERT-BUTYLPYROGALLOL

C10H14O3 (182.0942894)


   

3-Methyl α-Carboline

3-Methyl α-Carboline

C12H10N2 (182.084394)


   

1-METHYL-3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID

1-METHYL-3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID

C9H14N2O2 (182.1055224)


   

ethyl 5-ethyl-2-methylpyrazole-3-carboxylate

ethyl 5-ethyl-2-methylpyrazole-3-carboxylate

C9H14N2O2 (182.1055224)


   

1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid

1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid

C9H14N2O2 (182.1055224)


   

1-ethyl-3-methyl-1h-pyrazole-5-carboxylic acid ethyl ester

1-ethyl-3-methyl-1h-pyrazole-5-carboxylic acid ethyl ester

C9H14N2O2 (182.1055224)


   

9H-carbazol-2-amine

9H-carbazol-2-amine

C12H10N2 (182.084394)


   

2-AMINO-4-(TERT-BUTYL)-6-METHOXY-1,3,5-TRIAZINE

2-AMINO-4-(TERT-BUTYL)-6-METHOXY-1,3,5-TRIAZINE

C8H14N4O (182.1167554)


   

TRANS-STILBENE-α,α-D2

TRANS-STILBENE-α,α-D2

C14H10D2 (182.106449556)


   

4,6-Diethoxy-2-methylpyrimidine

4,6-Diethoxy-2-methylpyrimidine

C9H14N2O2 (182.1055224)


   

(1S,4R)-7,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid

(1S,4R)-7,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid

C10H14O3 (182.0942894)


   

ACETIC ACID, 2-CYCLOHEPTYLIDENE-, ETHYL ESTER

ACETIC ACID, 2-CYCLOHEPTYLIDENE-, ETHYL ESTER

C11H18O2 (182.1306728)


   

2,6-DIMETHYL-1,6-HEPTADIEN-4-OL ACETATE

2,6-DIMETHYL-1,6-HEPTADIEN-4-OL ACETATE

C11H18O2 (182.1306728)


   

4-(2,2-DIMETHOXY-ETHYL)-PHENOL

4-(2,2-DIMETHOXY-ETHYL)-PHENOL

C10H14O3 (182.0942894)


   

(3-AMINO-PYRIDIN-2-YL)-METHANOL

(3-AMINO-PYRIDIN-2-YL)-METHANOL

C10H14O3 (182.0942894)


   

5-tert-butyl-2-methylfuran-3-carboxylic acid

5-tert-butyl-2-methylfuran-3-carboxylic acid

C10H14O3 (182.0942894)


   

1-(2-Methoxyphenoxy)-2-propanol

1-(2-Methoxyphenoxy)-2-propanol

C10H14O3 (182.0942894)


   

5-ETHOXYCARBONYL-1H-HEXAHYDROPYRROLO[3,4-B]PYRROLE

5-ETHOXYCARBONYL-1H-HEXAHYDROPYRROLO[3,4-B]PYRROLE

C9H14N2O2 (182.1055224)


   

3-(3,5-Dimethyl-pyrazol-1-yl)-2-methyl-propionic acid

3-(3,5-Dimethyl-pyrazol-1-yl)-2-methyl-propionic acid

C9H14N2O2 (182.1055224)


   

(R)-(+)-3-Benzyloxy-1,2-propanediol

(R)-(+)-3-Benzyloxy-1,2-propanediol

C10H14O3 (182.0942894)


   

1-(TERT-BUTYL)-3-CHLORO-5-METHYLBENZENE

1-(TERT-BUTYL)-3-CHLORO-5-METHYLBENZENE

C11H15Cl (182.086222)


   

methyl 2,6-dimethyl-4-oxocyclohex-2-ene-1-carboxylate

methyl 2,6-dimethyl-4-oxocyclohex-2-ene-1-carboxylate

C10H14O3 (182.0942894)


   

1-(2,4-dimethoxyphenyl)ethanol

1-(2,4-dimethoxyphenyl)ethanol

C10H14O3 (182.0942894)


   

5-methylpyrido[4,3-b]indole

5-methylpyrido[4,3-b]indole

C12H10N2 (182.084394)


   

pent-4-enoyl pent-4-enoate

pent-4-enoyl pent-4-enoate

C10H14O3 (182.0942894)


   

2-Propenamide,N,N-methylenebis[2-methyl-

2-Propenamide,N,N-methylenebis[2-methyl-

C9H14N2O2 (182.1055224)


   

2-((3-Amino-4-methoxyphenyl)amino)ethanol

2-((3-Amino-4-methoxyphenyl)amino)ethanol

C9H14N2O2 (182.1055224)


   

2-Furancarboxylic acid,5-(1,1-dimethylethyl)-, methyl ester

2-Furancarboxylic acid,5-(1,1-dimethylethyl)-, methyl ester

C10H14O3 (182.0942894)


   

3-Furancarboxylic acid, 5-ethyl-2-methyl-, ethyl ester

3-Furancarboxylic acid, 5-ethyl-2-methyl-, ethyl ester

C10H14O3 (182.0942894)


   

5,6-Dihydro-3-(4-morpholinyl)-2(1H)-pyridinone

5,6-Dihydro-3-(4-morpholinyl)-2(1H)-pyridinone

C9H14N2O2 (182.1055224)


   

2-[(4-Methoxybenzyl)oxy]ethanol

2-[(4-Methoxybenzyl)oxy]ethanol

C10H14O3 (182.0942894)


   

1-(2-PROPYNYLOXY)-2-PROPANOL

1-(2-PROPYNYLOXY)-2-PROPANOL

C12H10N2 (182.084394)


   

2,5-DIMETHOXY-BENZYL-HYDRAZINE

2,5-DIMETHOXY-BENZYL-HYDRAZINE

C9H14N2O2 (182.1055224)


   

1-(3-METHYLBUTYL)-1H-PYRAZOLE-4-BORONIC ACID

1-(3-METHYLBUTYL)-1H-PYRAZOLE-4-BORONIC ACID

C8H15BN2O2 (182.12265200000002)


   
   

2-decalinyl formate

2-decalinyl formate

C11H18O2 (182.1306728)


   

2,4-dimethyl-3-cyclohexene-1-methanyl acetate

2,4-dimethyl-3-cyclohexene-1-methanyl acetate

C11H18O2 (182.1306728)


   

8-ethynyl-1,4-dioxaspiro[4.5]decan-8-ol

8-ethynyl-1,4-dioxaspiro[4.5]decan-8-ol

C10H14O3 (182.0942894)


   

3-methylbut-2-enoyl 3-methylbut-2-enoate

3-methylbut-2-enoyl 3-methylbut-2-enoate

C10H14O3 (182.0942894)


   

Ethyl 3-n-propylpyrazole-5-carboxylate

Ethyl 3-n-propylpyrazole-5-carboxylate

C9H14N2O2 (182.1055224)


   

3-(Phenylmethoxy)-1,2-propanediol

3-(Phenylmethoxy)-1,2-propanediol

C10H14O3 (182.0942894)


   

3-(chloromethyl)-1,2,4,5-tetramethylbenzene

3-(chloromethyl)-1,2,4,5-tetramethylbenzene

C11H15Cl (182.086222)


   

3-tert-butylsulfanylpyridin-4-amine

3-tert-butylsulfanylpyridin-4-amine

C9H14N2S (182.0877644)


   

1-(3,4-Dimethoxyphenyl)ethanol

1-(3,4-Dimethoxyphenyl)ethanol

C10H14O3 (182.0942894)


   

1-(Thien-3-ylmethyl)piperazine

1-(Thien-3-ylmethyl)piperazine

C9H14N2S (182.0877644)


   

ETHYLBIPHENYL

ETHYLBIPHENYL

C14H14 (182.1095444)


   

3-(tert-Butyl)-1H-pyrazole-5-carbohydrazide

3-(tert-Butyl)-1H-pyrazole-5-carbohydrazide

C8H14N4O (182.1167554)


   

4-(3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid(SALTDATA: FREE)

4-(3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid(SALTDATA: FREE)

C9H14N2O2 (182.1055224)


   

(S)-(-)-3-Benzyloxy-1,2-propanediol

(S)-(-)-3-Benzyloxy-1,2-propanediol

C10H14O3 (182.0942894)


   

3-methyl-3,8-diazaspiro[4.5]decane-2,4-dione

3-methyl-3,8-diazaspiro[4.5]decane-2,4-dione

C9H14N2O2 (182.1055224)


   

8-Methyl-2,8-diazaspiro[4.5]decane-1,3-dione

8-Methyl-2,8-diazaspiro[4.5]decane-1,3-dione

C9H14N2O2 (182.1055224)


   

2-(3-Oxobutyl)-1,3-cyclohexanedione

2-(3-Oxobutyl)-1,3-cyclohexanedione

C10H14O3 (182.0942894)


   

2,2-dimethoxyethoxybenzene

2,2-dimethoxyethoxybenzene

C10H14O3 (182.0942894)


   

2,8-diazaspiro[5.5]undecane-1,7-dione

2,8-diazaspiro[5.5]undecane-1,7-dione

C9H14N2O2 (182.1055224)


   

(S)-N-(1-(5-FLUOROPYRIDIN-2-YL)ETHYL)ACETAMIDE

(S)-N-(1-(5-FLUOROPYRIDIN-2-YL)ETHYL)ACETAMIDE

C9H11FN2O (182.0855368)


   

tert-Butyl 1H-pyrrol-1-ylcarbamate

tert-Butyl 1H-pyrrol-1-ylcarbamate

C9H14N2O2 (182.1055224)


   

Thiophene, 3-heptyl-

Thiophene, 3-heptyl-

C11H18S (182.1129148)


   

tert-Butyldimethylsilylimidazole

tert-Butyldimethylsilylimidazole

C9H18N2Si (182.1239188)


   

ethyl 4-cyanopiperidine-1-carboxylate

ethyl 4-cyanopiperidine-1-carboxylate

C9H14N2O2 (182.1055224)


   

2-(2-Phenoxyethoxy)ethanol

2-(2-Phenoxyethoxy)ethanol

C10H14O3 (182.0942894)


   

1-o-benzyl-rac-glycerol

1-o-benzyl-rac-glycerol

C10H14O3 (182.0942894)


   

ETHYL 3-(2-METHYL-1H-IMIDAZOL-1-YL)PROPANOATE

ETHYL 3-(2-METHYL-1H-IMIDAZOL-1-YL)PROPANOATE

C9H14N2O2 (182.1055224)


   

5-(AMINOMETHYL)-2-(TRIFLUOROMETHYL)PIPERIDINE

5-(AMINOMETHYL)-2-(TRIFLUOROMETHYL)PIPERIDINE

C7H13F3N2 (182.1030774)


   

Bicyclo[2.2.1]heptane-1-carboxylic acid, 7,7-dimethyl-2-oxo-, (1R,4S)-

Bicyclo[2.2.1]heptane-1-carboxylic acid, 7,7-dimethyl-2-oxo-, (1R,4S)-

C10H14O3 (182.0942894)


   

cyclotene butyrate

cyclotene butyrate

C10H14O3 (182.0942894)


   

Ethyl5-isopropylpyrazole-3-carboxylate

Ethyl5-isopropylpyrazole-3-carboxylate

C9H14N2O2 (182.1055224)


   

2-(2-ethoxyphenoxy)ethanol

2-(2-ethoxyphenoxy)ethanol

C10H14O3 (182.0942894)


   

3-(4-METHOXYPHENOXY)-1-PROPANOL

3-(4-METHOXYPHENOXY)-1-PROPANOL

C10H14O3 (182.0942894)


   

1,3,5-Triazine-2,4,6-triamine,N2,N2-diethyl-

1,3,5-Triazine-2,4,6-triamine,N2,N2-diethyl-

C7H14N6 (182.1279884)


   

3-methylbutyl 2-furoate

3-methylbutyl 2-furoate

C10H14O3 (182.0942894)


   

Ethyl (E)-3-cyclohexyl-2-propenoate

Ethyl (E)-3-cyclohexyl-2-propenoate

C11H18O2 (182.1306728)


   

(3,4-dimethoxyphenyl)methylhydrazine

(3,4-dimethoxyphenyl)methylhydrazine

C9H14N2O2 (182.1055224)


   

4-Ethylbiphenyl

4-Ethylbiphenyl

C14H14 (182.1095444)


   

Mildronate

Mildronate

C6H18N2O4 (182.1266508)


Meldonium (MET-88) dihydrate functions as a cardioprotective agent by cpmpetetively inhibiting γ-butyrobetaine hydroxylase (BBOX) and carnitine/organic cation transporter type 2 (OCTN2). Mildronate dihydrate exhibits IC50 values of 34-62 μM for human recombinant BBOX and an EC50 of 21 μM for human OCTN2. Meldonium dihydrate is a fatty acid oxidation inhibitor[1][2].

   

1-(3-METHOXYBENZYL)-1H-INDAZOL-5-AMINE

1-(3-METHOXYBENZYL)-1H-INDAZOL-5-AMINE

C10H14O3 (182.0942894)


   

3-Ethylbiphenyl

3-Ethylbiphenyl

C14H14 (182.1095444)


   

Urea, 1,1-dimethyl-3-(p-fluorophenyl)-

Urea, 1,1-dimethyl-3-(p-fluorophenyl)-

C9H11FN2O (182.0855368)


   

Ethyl 4-bromo-1,3-dimethylpyrazole-5-carboxylate

Ethyl 4-bromo-1,3-dimethylpyrazole-5-carboxylate

C9H14N2O2 (182.1055224)


   

2-cyclohex-3-en-1-yl-4-methyl-1,3-dioxane

2-cyclohex-3-en-1-yl-4-methyl-1,3-dioxane

C11H18O2 (182.1306728)


   

3-tert-Butylsulfanyl-pyridin-2-ylamine

3-tert-Butylsulfanyl-pyridin-2-ylamine

C9H14N2S (182.0877644)


   

3-(2-ISOPROPYL-IMIDAZOL-1-YL)-PROPIONIC ACID

3-(2-ISOPROPYL-IMIDAZOL-1-YL)-PROPIONIC ACID

C9H14N2O2 (182.1055224)


   

5-(4-methylpiperazin-1-yl)-1H-1,2,4-triazol-3-amine

5-(4-methylpiperazin-1-yl)-1H-1,2,4-triazol-3-amine

C7H14N6 (182.1279884)


   

3,3-Dimethylbiphenyl

3,3-Dimethylbiphenyl

C14H14 (182.1095444)


   

4-amino-1-methyl-3-propylpyrazole-5-formylamine

4-amino-1-methyl-3-propyl-1H-pyrazole-5-carboxamide

C8H14N4O (182.1167554)


   

2-methyl-2,5-adamantanediol

2-methyl-2,5-adamantanediol

C11H18O2 (182.1306728)


   

2-(Benzyloxy)-1,3-propanediol

2-(Benzyloxy)-1,3-propanediol

C10H14O3 (182.0942894)


   

Benzene,1-methyl-4-(phenylmethyl)-

Benzene,1-methyl-4-(phenylmethyl)-

C14H14 (182.1095444)


   

2-Pyrrolidinone,5-(1-pyrrolidinylcarbonyl)-

2-Pyrrolidinone,5-(1-pyrrolidinylcarbonyl)-

C9H14N2O2 (182.1055224)


   

(2-FLUORO-5-ISOPROPYLPHENYL)BORONIC ACID

(2-FLUORO-5-ISOPROPYLPHENYL)BORONIC ACID

C9H12BFO2 (182.0914334)


   

benzyltoluene

benzyltoluene

C14H14 (182.1095444)


   

3-HYDROXY-5-PENTYLCYCLOHEX-2-ENONE

3-HYDROXY-5-PENTYLCYCLOHEX-2-ENONE

C11H18O2 (182.1306728)


   

1H-Pyrazole-3-carboxylicacid,5-ethyl-1-methyl-,ethylester(9CI)

1H-Pyrazole-3-carboxylicacid,5-ethyl-1-methyl-,ethylester(9CI)

C9H14N2O2 (182.1055224)


   

3,6-nonadien-1-yl acetate

3,6-nonadien-1-yl acetate

C11H18O2 (182.1306728)


   

1,1-Cyclohexanediacetic anhydride

1,1-Cyclohexanediacetic anhydride

C10H14O3 (182.0942894)


   

(R)-α-Terpinyl formate

(R)-α-Terpinyl formate

C11H18O2 (182.1306728)


   

4-(3-Fluoro-2-pyridinyl)morpholine

4-(3-Fluoro-2-pyridinyl)morpholine

C9H11FN2O (182.0855368)


   

1-(2,5-Dimethoxyphenyl)ethanol

1-(2,5-Dimethoxyphenyl)ethanol

C10H14O3 (182.0942894)


   

Benzene,1-methyl-2-(phenylmethyl)-

Benzene,1-methyl-2-(phenylmethyl)-

C14H14 (182.1095444)


   

methoxy[tri(prop-2-enyl)]silane

methoxy[tri(prop-2-enyl)]silane

C10H18OSi (182.1126858)


   

1,3,5-trimethoxy-2-methylbenzene

1,3,5-trimethoxy-2-methylbenzene

C10H14O3 (182.0942894)


   

Ethylcyclohexyl-acryrate

Ethylcyclohexyl-acryrate

C11H18O2 (182.1306728)


   

3,3a,4,5,7,7a-Hexahydro-4,4,7a-trimethyl-6(2H)-benzofuranone

3,3a,4,5,7,7a-Hexahydro-4,4,7a-trimethyl-6(2H)-benzofuranone

C11H18O2 (182.1306728)


   

(4E)-3-Isopropyl-6-methyl-4,6-heptadienoic acid

(4E)-3-Isopropyl-6-methyl-4,6-heptadienoic acid

C11H18O2 (182.1306728)


   

2-Ethyl-5,6-dimethoxyphenol

2-Ethyl-5,6-dimethoxyphenol

C10H14O3 (182.0942894)


   

4-(tert-Butyl)-6-hydrazino-1,3,5-triazin-2-amine

4-(tert-Butyl)-6-hydrazino-1,3,5-triazin-2-amine

C7H14N6 (182.1279884)


   

ethyl 3-(1-Methyl-1H-pyrazol-4-yl)propanoate

ethyl 3-(1-Methyl-1H-pyrazol-4-yl)propanoate

C9H14N2O2 (182.1055224)


   

trans-(4-(trifluoromethyl)cyclohexyl)methanol

trans-(4-(trifluoromethyl)cyclohexyl)methanol

C8H13F3O (182.09184439999999)


   

tert-butyl 1H-pyrrol-2-ylcarbamate

tert-butyl 1H-pyrrol-2-ylcarbamate

C9H14N2O2 (182.1055224)


   

4-methylcyclohexyl methacrylate

4-methylcyclohexyl methacrylate

C11H18O2 (182.1306728)


   

2-(2-Propyn-1-yl)octanoic acid

2-(2-Propyn-1-yl)octanoic acid

C11H18O2 (182.1306728)


   

4-tert-butyl-2-(Methylthio)pyrimidine

4-tert-butyl-2-(Methylthio)pyrimidine

C9H14N2S (182.0877644)


   

1,3-Dimethyl-2-(2-thienyl)imidazolidine

1,3-Dimethyl-2-(2-thienyl)imidazolidine

C9H14N2S (182.0877644)


   

3-(3,5-dimethyl-1H-pyrazol-1-yl)propanohydrazide

3-(3,5-dimethyl-1H-pyrazol-1-yl)propanohydrazide

C8H14N4O (182.1167554)


   

3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

3,5-dimethyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

C9H14N2O2 (182.1055224)


   

4-(Propylsulfanyl)-1,2-benzenediamine

4-(Propylsulfanyl)-1,2-benzenediamine

C9H14N2S (182.0877644)


   

1-(3,5-Dimethoxyphenyl)ethanol

1-(3,5-Dimethoxyphenyl)ethanol

C10H14O3 (182.0942894)


   

5-PENTYL-CYCLOHEXANE-1,3-DIONE

5-PENTYL-CYCLOHEXANE-1,3-DIONE

C11H18O2 (182.1306728)


   

2,4-Dimethoxy-3-methylbenzyl alcohol

2,4-Dimethoxy-3-methylbenzyl alcohol

C10H14O3 (182.0942894)


   

1-methyl-5-(2-methylpropyl)pyrazole-3-carboxylic acid

1-methyl-5-(2-methylpropyl)pyrazole-3-carboxylic acid

C9H14N2O2 (182.1055224)


   

boron allyloxide

boron allyloxide

C9H15BO3 (182.111419)


   
   

(Z)-3-hexen-1-yl senecioate

(Z)-3-hexen-1-yl senecioate

C11H18O2 (182.1306728)


   

3,9-Diazaspiro[5.5]undecane-2,4-dione

3,9-Diazaspiro[5.5]undecane-2,4-dione

C9H14N2O2 (182.1055224)


   

4,5,6,7,8,9-hexahydrocycloocta[d][1,3]thiazol-2-amine

4,5,6,7,8,9-hexahydrocycloocta[d][1,3]thiazol-2-amine

C9H14N2S (182.0877644)


   

2-ethyl-5-propan-2-ylpyrazole-3-carboxylic acid

2-ethyl-5-propan-2-ylpyrazole-3-carboxylic acid

C9H14N2O2 (182.1055224)


   

3-(3,4,5-trimethyl-1H-pyrazol-1-yl)propanoic acid

3-(3,4,5-trimethyl-1H-pyrazol-1-yl)propanoic acid

C9H14N2O2 (182.1055224)


   

3-(3,5-dimethyl-1H-pyrazol-4-yl)propanohydrazide

3-(3,5-dimethyl-1H-pyrazol-4-yl)propanohydrazide

C8H14N4O (182.1167554)


   

7,7-DIMETHYL-2-OXOBICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID

7,7-DIMETHYL-2-OXOBICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID

C10H14O3 (182.0942894)


   

Ethyl 3-amino-5-ethyl-1H-pyrrole-2-carboxylate

Ethyl 3-amino-5-ethyl-1H-pyrrole-2-carboxylate

C9H14N2O2 (182.1055224)


   

2-Cyclohexylcyclopropanecarboxylic acid methyl ester

2-Cyclohexylcyclopropanecarboxylic acid methyl ester

C11H18O2 (182.1306728)


   

5-(1-methylpiperidin-4-yl)-1,3,4-oxadiazol-2-amine

5-(1-methylpiperidin-4-yl)-1,3,4-oxadiazol-2-amine

C8H14N4O (182.1167554)


   
   

1,4-diazaspiro[5.5]undecane-3,5-dione

1,4-diazaspiro[5.5]undecane-3,5-dione

C9H14N2O2 (182.1055224)


   

1-(dimethoxymethyl)-3-methoxybenzene

1-(dimethoxymethyl)-3-methoxybenzene

C10H14O3 (182.0942894)


   

bis(methylcyclopentadienyl)magnesium

bis(methylcyclopentadienyl)magnesium

C12H14Mg (182.0945944)


   
   

5-chloropentylbenzene

5-chloropentylbenzene

C11H15Cl (182.086222)


   

6-(4-MORPHOLINYL)PYRAZINAMINE

6-(4-MORPHOLINYL)PYRAZINAMINE

C8H14N4O (182.1167554)


   

ETHYL 1,3,5-TRIMETHYL-1H-PYRAZOLE-4-CARBOXYLATE

ETHYL 1,3,5-TRIMETHYL-1H-PYRAZOLE-4-CARBOXYLATE

C9H14N2O2 (182.1055224)


   

4-ethoxy-3-methoxybenzyl alcohol

4-ethoxy-3-methoxybenzyl alcohol

C10H14O3 (182.0942894)


   

1-Boc-3-cyano azetidine

1-Boc-3-cyano azetidine

C9H14N2O2 (182.1055224)


   

Benzeneethanol, b,b-dimethoxy-

Benzeneethanol, b,b-dimethoxy-

C10H14O3 (182.0942894)


   

4-Cyano-2,2,5,5-tetramethyl-3-imidazoline-3-oxide-1-oxyl

4-Cyano-2,2,5,5-tetramethyl-3-imidazoline-3-oxide-1-oxyl

C8H12N3O2 (182.0929472)


   

dl-camphoric anhydride

dl-camphoric anhydride

C10H14O3 (182.0942894)


   

2-(2,4-Dimethoxyphenyl)ethanol

2-(2,4-Dimethoxyphenyl)ethanol

C10H14O3 (182.0942894)


   

3,5-Dimethoxyphenethyl alcohol

3,5-Dimethoxyphenethyl alcohol

C10H14O3 (182.0942894)


   

Benzeneethanol,2,5-dimethoxy-

Benzeneethanol,2,5-dimethoxy-

C10H14O3 (182.0942894)


   

(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetic acid(SALTDATA: FREE)

(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetic acid(SALTDATA: FREE)

C9H14N2O2 (182.1055224)


   

2-(3,4,5-trimethyl-1H-pyrazol-1-yl)acetohydrazide(SALTDATA: FREE)

2-(3,4,5-trimethyl-1H-pyrazol-1-yl)acetohydrazide(SALTDATA: FREE)

C8H14N4O (182.1167554)


   

1,3-Cyclohexanedione,2-(diaminomethylene)-5,5-dimethyl-(9CI)

1,3-Cyclohexanedione,2-(diaminomethylene)-5,5-dimethyl-(9CI)

C9H14N2O2 (182.1055224)


   

Pyrimidine, 5-fluoro-2-(1-piperazinyl)- (9CI)

Pyrimidine, 5-fluoro-2-(1-piperazinyl)- (9CI)

C8H11FN4 (182.0967698)


   

Propylene oxide adduct of phenol, formaldehyde polymer

Propylene oxide adduct of phenol, formaldehyde polymer

C10H14O3 (182.0942894)


   
   

8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C9H14N2O2 (182.1055224)


   

N(2),N(2),N(4),N(6)-Tetramethylmelamine

N(2),N(2),N(4),N(6)-Tetramethylmelamine

C7H14N6 (182.1279884)


   

MELAMINE, N(sup 2),N(sup 2),N(sup 4),N(sup 4)-TETRAMETHYL-

MELAMINE, N(sup 2),N(sup 2),N(sup 4),N(sup 4)-TETRAMETHYL-

C7H14N6 (182.1279884)


   

methyl (E,Z)-2,4-decadienoate

2,4-Decadienoic acid, methyl ester, (2E,4E)-

C11H18O2 (182.1306728)


   

1,2-Dimethoxy-4-(methoxymethyl)benzene

1,2-Dimethoxy-4-(methoxymethyl)benzene

C10H14O3 (182.0942894)


   

Bjerkanderol A

erythro-Anethole glycol

C10H14O3 (182.0942894)


Isolated from Foeniculum vulgare (fennel). erythro-Anethole glycol is found in herbs and spices and anise.

   
   

(-)-2-Difluoromethylornithine

(-)-2-Difluoromethylornithine

C6H12F2N2O2 (182.0866796)


   

5,5-Dimethyl-2-propylcyclohexane-1,3-dione

5,5-Dimethyl-2-propylcyclohexane-1,3-dione

C11H18O2 (182.1306728)


   

1H-Indene-1,5(4H)-dione, hexahydro-3a-hydroxy-7a-methyl-

1H-Indene-1,5(4H)-dione, hexahydro-3a-hydroxy-7a-methyl-

C10H14O3 (182.0942894)


   

5-Isobutyl-2-methyl-furan-3-carboxylic acid

5-Isobutyl-2-methyl-furan-3-carboxylic acid

C10H14O3 (182.0942894)


   

alpha-Methyl-2,3-dimethoxybenzyl Alcohol

alpha-Methyl-2,3-dimethoxybenzyl Alcohol

C10H14O3 (182.0942894)


   

2-(1-Methyl-3-oxobutyl)cyclohexanone

2-(1-Methyl-3-oxobutyl)cyclohexanone

C11H18O2 (182.1306728)


   

1H-Pyrazole, 3,4,5-trimethyl-1-(trimethylsilyl)-

1H-Pyrazole, 3,4,5-trimethyl-1-(trimethylsilyl)-

C9H18N2Si (182.1239188)


   

92196_FLUKA

InChI=1\C10H14O3\c1-7-5-8(11-2)10(13-4)9(6-7)12-3\h5-6H,1-4H

C10H14O3 (182.0942894)


   

1189-09-9

2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (2E)-

C11H18O2 (182.1306728)


   

AI3-01978

formic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester

C11H18O2 (182.1306728)


   

Dibenzil

InChI=1\C14H14\c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14\h1-10H,11-12H

C14H14 (182.1095444)


   

FR-2153

4-02-00-01738 (Beilstein Handbook Reference)

C11H18O2 (182.1306728)


   

Methyl geranate

Methyl (2E)-3,7-dimethylocta-2,6-dienoic acid

C11H18O2 (182.1306728)


Methyl geranate, also known as methyl geranic acid or methyl (2e)-3,7-dimethylocta-2,6-dienoate, is a member of the class of compounds known as acyclic monoterpenoids. Acyclic monoterpenoids are monoterpenes that do not contain a cycle. Methyl geranate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Methyl geranate can be found in caraway, which makes methyl geranate a potential biomarker for the consumption of this food product. Methyl geranate exists in all eukaryotes, ranging from yeast to humans. Methyl_geranate belongs to the family of Acyclic Monoterpenes. These are monoterpenes (compounds made of two consecutive isoprene units) that do not contain a cycle.

   

(±)-erythro-Anethole glycol

1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


Constituent of Illicium verum (Chinese star anise). (¬±)-erythro-Anethole glycol is found in fruits. Constituent of Illicium verum (Chinese star anise). (±)-erythro-Anethole glycol is found in fruits.

   

8-Hydroxy-3-methyl-3,4,4a,5,6,7-hexahydro-1H-2-benzopyran-1-one

8-Hydroxy-3-methyl-3,4,4a,5,6,7-hexahydro-1H-2-benzopyran-1-one

C10H14O3 (182.0942894)


   

(E)-2-Hexenyl tiglate

(E)-2-Hexenyl tiglate

C11H18O2 (182.1306728)


   

1-Hydroxy-4-oxahomoadamantan-5-one

1-Hydroxy-4-oxahomoadamantan-5-one

C10H14O3 (182.0942894)


   

7-Deoxyloganetic aldehyde

7-Deoxyloganetic aldehyde

C10H14O3 (182.0942894)


A cyclopentapyran that is (4aS,7aR)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran substituted at position 1 by a hydroxy group and at positions 4 and 7 by a formyl and methyl group, respectively (the 1R,4aS,7S,7aR-diastereomer).

   

[(2R,3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]azanium

[(2R,3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]azanium

C6H16NO5+ (182.1028426)


   
   

(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol

(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol

C10H14O3 (182.0942894)


   

5-[(E)-dimethylaminodiazenyl]-1H-imidazole-2-carboxamide

5-[(E)-dimethylaminodiazenyl]-1H-imidazole-2-carboxamide

C6H10N6O (182.09160500000002)


   

(2E)-2,3,7-Trimethylocta-2,6-dienoic acid

(2E)-2,3,7-Trimethylocta-2,6-dienoic acid

C11H18O2 (182.1306728)


   

isobornyl formate

isobornyl formate

C11H18O2 (182.1306728)


A bornane monoterpenoid that is isoborneol in which the hydroxy hydrogen has been replaced by a formyl group.

   

Methyl 4,8-decadienoate

Methyl 4,8-decadienoate

C11H18O2 (182.1306728)


   

(+)-5-Oxo-1,2-campholide

(+)-5-Oxo-1,2-campholide

C10H14O3 (182.0942894)


   

(5Z,8Z)-1,5,8-undecatriene-3,7-diol

(5Z,8Z)-1,5,8-undecatriene-3,7-diol

C11H18O2 (182.1306728)


   

(Z)-3-Hexenyl tiglate

(E)-(Z)-Hex-3-en-1-yl 2-methylbut-2-enoate

C11H18O2 (182.1306728)


   

3-Methylbutyl 2,4-hexadienoate

3-Methylbutyl 2,4-hexadienoate

C11H18O2 (182.1306728)


   

3,5-Dimethoxy-2,4-dimethylphenol

3,5-Dimethoxy-2,4-dimethylphenol

C10H14O3 (182.0942894)


   

1-Acetyl-4,4-ethylenedioxycyclohexene

1-Acetyl-4,4-ethylenedioxycyclohexene

C10H14O3 (182.0942894)


   

2,6,6-Trimethyl-3-ethylcarbonyl-5,6-dihydro-4H-pyran

2,6,6-Trimethyl-3-ethylcarbonyl-5,6-dihydro-4H-pyran

C11H18O2 (182.1306728)


   

5-Hydroxy-1-methylbicyclo(4.3.0)nonane-2,7-dione

5-Hydroxy-1-methylbicyclo(4.3.0)nonane-2,7-dione

C10H14O3 (182.0942894)


   

6-(3-Methyl-2-butenyloxy)-4-methyl-5,6-dihydro-2H-pyran

6-(3-Methyl-2-butenyloxy)-4-methyl-5,6-dihydro-2H-pyran

C11H18O2 (182.1306728)


   

Dacarbazine

Dacarbazine, Pharmaceutical Secondary Standard; Certified Reference Material

C6H10N6O (182.09160500000002)


L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents Dacarbazine appears as white to ivory microcrystals or off-white crystalline solid. (NTP, 1992) (E)-dacarbazine is a dacarbazine in which the N=N double bond adopts a trans-configuration. An antineoplastic agent. It has significant activity against melanomas. (from Martindale, The Extra Pharmacopoeia, 31st ed, p564). Dacarbazine with Oblimersen is in clinical trials for the treatment of malignant melanoma. Dacarbazine is an Alkylating Drug. The mechanism of action of dacarbazine is as an Alkylating Activity. Dacarbazine (also known as DTIC) is an intravenously administered alkylating agent used in the therapy of Hodgkin disease and malignant melanoma. Dacarbazine therapy has been associated with serum enzyme elevations during therapy and occasional cases of severe and distinctive acute hepatic failure, probably caused by acute sinusoidal obstruction syndrome. Dacarbazine is a triazene derivative with antineoplastic activity. Dacarbazine alkylates and cross-links DNA during all phases of the cell cycle, resulting in disruption of DNA function, cell cycle arrest, and apoptosis. (NCI04) An antineoplastic agent. It has significant activity against melanomas. (from Martindale, The Extra Pharmacopoeia, 31st ed, p564) C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent

   

SOMAN

SOMAN

C7H16FO2P (182.0871898)


D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D009676 - Noxae > D011042 - Poisons > D002619 - Chemical Warfare Agents D004791 - Enzyme Inhibitors

   

MIPAFOX

PHOSPHORODI(ISOPROPYLAMIDIC) FLUORIDE

C6H16FN2OP (182.09842279999998)


   

EFLORNITHINE

2-(Difluoromethyl)-DL-ornithine

C6H12F2N2O2 (182.0866796)


P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01C - Agents against leishmaniasis and trypanosomiasis C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D004791 - Enzyme Inhibitors > D065108 - Ornithine Decarboxylase Inhibitors C471 - Enzyme Inhibitor > C2088 - Ornithine Decarboxylase Inhibitor D000970 - Antineoplastic Agents D - Dermatologicals

   

BIS(2,3-EPOXYCYCLOPENTYL) ETHER

BIS(2,3-EPOXYCYCLOPENTYL) ETHER

C10H14O3 (182.0942894)


   

3,4,5-Trimethoxytoluene

1,2,3-Trimethoxy-5-methylbenzene

C10H14O3 (182.0942894)


   

(2,2,3-Trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid

(2,2,3-Trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid

C10H14O3 (182.0942894)


   

(1S,2R,3S)-2-Formyl-alpha-(hydroxymethylene)-3-methylcyclopentaneacetaldehyde

(1S,2R,3S)-2-Formyl-alpha-(hydroxymethylene)-3-methylcyclopentaneacetaldehyde

C10H14O3 (182.0942894)


   

cis-3-Hexenyl tiglate

cis-3-Hexenyl tiglate

C11H18O2 (182.1306728)


   

Dibenzyl

1,2-dihydrostilbene

C14H14 (182.1095444)


   

Ethyl 2-nonynoate

Ethyl 2-nonynoate

C11H18O2 (182.1306728)


   

Allyl cyclohexaneacetate

Allyl cyclohexaneacetate

C11H18O2 (182.1306728)


   
   

4-Ethyl-2,6-dimethoxyphenol

4-Ethyl-2,6-dimethoxyphenol

C10H14O3 (182.0942894)


   

(e,z)-3,6-nonadien-1-yl acetate

3,6-Nonadien-1-ol, acetate, (3E,6Z)-

C11H18O2 (182.1306728)


   

3(2H)-Furanone, 2-hexyl-5-methyl-

3(2H)-Furanone, 2-hexyl-5-methyl-

C11H18O2 (182.1306728)


   

cis-jasmonolactone

(e)-3-hexenyldihydro-5-Methylfuran-2(3H)-one

C11H18O2 (182.1306728)


   

3,6-Dimethyl-7a-hydroxy-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one

3,6-Dimethyl-7a-hydroxy-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one

C10H14O3 (182.0942894)


   

(2E,6Z)-Nona-2,6-dienyl acetate

(2E,6Z)-Nona-2,6-dienyl acetate

C11H18O2 (182.1306728)


   
   

(-)-5-oxo-1,2-campholide

(-)-5-oxo-1,2-campholide

C10H14O3 (182.0942894)


   

(e)-Geranyl formate

(e)-Geranyl formate

C11H18O2 (182.1306728)


The formate ester of geraniol.

   
   

Undecadienoic acid

Undecadienoic acid

C11H18O2 (182.1306728)