Exact Mass: 250.1681192

Exact Mass Matches: 250.1681192

Found 500 metabolites which its exact mass value is equals to given mass value 250.1681192, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Gemfibrozil

2,2-Dimethyl-5-(2,5-dimethylphenoxy)valeriansaeure

C15H22O3 (250.1568862)


A lipid-regulating agent that lowers elevated serum lipids primarily by decreasing serum triglycerides with a variable reduction in total cholesterol. These decreases occur primarily in the VLDL fraction and less frequently in the LDL fraction. Gemfibrozil increases HDL subfractions HDL2 and HDL3 as well as apolipoproteins A-I and A-II. Its mechanism of action has not been definitely established. [PubChem] CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5593; ORIGINAL_PRECURSOR_SCAN_NO 5591 CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5614; ORIGINAL_PRECURSOR_SCAN_NO 5613 CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5641; ORIGINAL_PRECURSOR_SCAN_NO 5637 CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5627; ORIGINAL_PRECURSOR_SCAN_NO 5624 CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5626; ORIGINAL_PRECURSOR_SCAN_NO 5624 CONFIDENCE standard compound; INTERNAL_ID 448; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5624; ORIGINAL_PRECURSOR_SCAN_NO 5622 C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065687 - Cytochrome P-450 CYP2C8 Inhibitors C - Cardiovascular system > C10 - Lipid modifying agents > C10A - Lipid modifying agents, plain > C10AB - Fibrates D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents CONFIDENCE standard compound; INTERNAL_ID 4077 CONFIDENCE standard compound; INTERNAL_ID 2691 D009676 - Noxae > D000963 - Antimetabolites Gemfibrozil is an activator of PPAR-α, used as a lipid-lowering agent; Gemfibrozil is also a nonselective inhibitor of several P450 isoforms, with Ki values for CYP2C9, 2C19, 2C8, and 1A2 of 5.8, 24, 69, and 82 μM, respectively.

   

Rivastigmine

(S)-N-Ethyl-3-((1-dimethyl-amino)ethyl)-N-methylphenylcarbamate

C14H22N2O2 (250.1681192)


Rivastigmine is only found in individuals that have used or taken this drug. It is a parasympathomimetic or cholinergic agent for the treatment of mild to moderate dementia of the Alzheimers type. Rivastigmine is a cholinesterase inhibitor that inhibits both butyrylcholinesterase and acetylcholinesterase.Rivastigmine is a carbamate derivative that is structurally related to physostigmine, but not to donepezil and tacrine. The precise mechanism of rivastigmine has not been fully determined, but it is suggested that rivastigmine binds reversibly with and inactivates chlolinesterase (eg. acetylcholinesterase, butyrylcholinesterase), preventing the hydrolysis of acetycholine, and thus leading to an increased concentration of acetylcholine at cholinergic synapses. The anticholinesterase activity of rivastigmine is relatively specific for brain acetylcholinesterase and butyrylcholinesterase compared with those in peripheral tissues. D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors N - Nervous system > N06 - Psychoanaleptics > N06D - Anti-dementia drugs > N06DA - Anticholinesterases D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor CONFIDENCE standard compound; EAWAG_UCHEM_ID 2844 EAWAG_UCHEM_ID 2844; CONFIDENCE standard compound D020011 - Protective Agents D004791 - Enzyme Inhibitors

   

3-Hydroxylidocaine

2-(diethylamino)-N-(3-hydroxy-2,6-dimethylphenyl)acetamide

C14H22N2O2 (250.1681192)


3-Hydroxylidocaine is a metabolite of lidocaine. Lidocaine, Xylocaine, or lignocaine is a common local anesthetic and antiarrhythmic drug. Lidocaine is used topically to relieve itching, burning and pain from skin inflammations, injected as a dental anesthetic or as a local anesthetic for minor surgery. (Wikipedia)

   

cis-N-methyl-alpha-berbine

6a-Methyl-5,6,6a,7,12,12a-hexahydro-6a-azoniabenzo[a]anthracene

C18H20N+ (250.159566)


   

Arbusculin A

[3aS-(3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


A sesquiterpene lactone isolated from Saussureae Radix and has been shown to exhibit inhibitory activity against melanogenesis.

   

Ipomeamarone

(2S,5R)-4-methyl-l-(5-methyl-2,3,4,5-tetrahydro[2 ,3 -bifuran]-5-yl)pentan-2-one

C15H22O3 (250.1568862)


   

Piperdial

4-hydroxy-2,2,8-trimethyl-3,3a,4,5,8,8a-hexahydro-1H-azulene-5,6-dicarbaldehyde

C15H22O3 (250.1568862)


Piperdial is found in mushrooms. Piperdial is a constituent of Lactarius piperatus Constituent of Lactarius piperatus. Piperdial is found in mushrooms.

   
   

2-cis,4-trans-xanthoxin

(2Z,4E)-5-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3-methylpenta-2,4-dienal

C15H22O3 (250.1568862)


2-cis,4-trans-xanthoxin, also known as xanthoxin, is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. 2-cis,4-trans-xanthoxin is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 2-cis,4-trans-xanthoxin can be found in a number of food items such as broad bean, canola, mustard spinach, and hickory nut, which makes 2-cis,4-trans-xanthoxin a potential biomarker for the consumption of these food products. D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids

   

Abscisic alcohol

4-hydroxy-4-[(1E,3E)-5-hydroxy-3-methylpenta-1,3-dien-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one

C15H22O3 (250.1568862)


Abscisic alcohol is found in fruits. Abscisic alcohol is a constituent of quince (Cydonia oblonga) fruit. Constituent of quince (Cydonia oblonga) fruit. Abscisic alcohol is found in fruits.

   

1-Deoxy-11beta-hydroxypentalenate

(2S,3R,5R,8S)-3-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

C15H22O3 (250.1568862)


   

Pentalenate

(2R,5R,8S,9R)-9-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

C15H22O3 (250.1568862)


(2R,5R,8S,9R)-9-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid is a sesquiterpenoid.

   

6alpha-hydroxy-germacra-1(10),4,11(13)-trien-12-oate

2-[(1S,2R,3E,7E)-2-Hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

C15H22O3 (250.1568862)


   

2-Ethylhexylparaben

2-Ethylhexyl-4-hydroxybenzoate

C15H22O3 (250.1568862)


CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5047; ORIGINAL_PRECURSOR_SCAN_NO 5044 CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5052; ORIGINAL_PRECURSOR_SCAN_NO 5050 CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5050; ORIGINAL_PRECURSOR_SCAN_NO 5048 CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5060; ORIGINAL_PRECURSOR_SCAN_NO 5057 CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5067; ORIGINAL_PRECURSOR_SCAN_NO 5062 CONFIDENCE standard compound; INTERNAL_ID 762; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5044; ORIGINAL_PRECURSOR_SCAN_NO 5041

   

8beta-hydroxygermacrene A acid

8beta-hydroxygermacrene A acid

C15H22O3 (250.1568862)


   

2-[(1R,3E,7E,10S)-10-Hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

2-[(1R,3E,7E,10S)-10-Hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

C15H22O3 (250.1568862)


   

Valerenolic acid

(2E)-3-(1-hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid

C15H22O3 (250.1568862)


Constituent of the roots of Valeriana officinalis (valerian). Valerenolic acid is found in tea, fats and oils, and herbs and spices. Valerenolic acid is found in fats and oils. Valerenolic acid is a constituent of the roots of Valeriana officinalis (valerian).

   

(6beta,8alpha)-6-Hydroxy-7(11)-eremophilen-12,8-olide

4-hydroxy-3,4a,5-trimethyl-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

C15H22O3 (250.1568862)


(6beta,8alpha)-6-Hydroxy-7(11)-eremophilen-12,8-olide is found in giant butterbur. (6beta,8alpha)-6-Hydroxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot) Constituent of Petasites japonicus (sweet coltsfoot). 6b-Hydroxy-7(11)-eremophilen-12,8a-olide is found in giant butterbur and green vegetables.

   

Procurcumadiol

3,3a-dihydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one

C15H22O3 (250.1568862)


Procurcumadiol is found in herbs and spices. Procurcumadiol is a constituent of Curcuma longa (turmeric) Constituent of Curcuma longa (turmeric). Procurcumadiol is found in turmeric and herbs and spices.

   

Lactaronecatorin A

3-[2-(4,4-dimethylcyclopent-1-en-1-yl)propyl]-4-(hydroxymethyl)-2,5-dihydrofuran-2-one

C15H22O3 (250.1568862)


Lactaronecatorin A is found in mushrooms. Lactaronecatorin A is a constituent of Lactarius blennius (slimy milk cap). Constituent of Lactarius blennius (slimy milk cap). Lactaronecatorin A is found in mushrooms.

   

Ketosantalic acid

5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methyl-4-oxopentanoic acid

C15H22O3 (250.1568862)


Ketosantalic acid is a flavouring ingredient. Ketosantalic acid is a constituent of Indian sandalwood oi Flavouring ingredient. Constituent of Indian sandalwood oil

   

Blennin A

4-hydroxy-6,6,8-trimethyl-1H,3H,3aH,4H,4aH,5H,6H,7H,7aH,8H-azuleno[5,6-c]furan-1-one

C15H22O3 (250.1568862)


Blennin A is found in mushrooms. Blennin A is a constituent of Lactarius blennius (slimy milk cap) Constituent of Lactarius blennius (slimy milk cap). Blennin A is found in mushrooms.

   

13-Hydroxymarasmene

{5-methyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-en-5-yl}methanol

C15H22O3 (250.1568862)


14-Hydroxymarasmene is found in mushrooms. 14-Hydroxymarasmene is a metabolite of Marasmius oreades (fairy ring mushroom

   

Ketopelenolide a

3,6,10-trimethyl-2H,3H,3aH,4H,5H,8H,9H,10H,11H,11aH-cyclodeca[b]furan-2,9-dione

C15H22O3 (250.1568862)


From Artemisia absinthium (wormwood). Ketopelenolide a is found in alcoholic beverages and herbs and spices. Ketopelenolide b is found in alcoholic beverages. Ketopelenolide b is from Artemisia absinthium (wormwood).

   

Cadabicilone

3,5a,9-trimethyl-octahydro-3H-naphtho[1,2-b]furan-2,8-dione

C15H22O3 (250.1568862)


Cadabicilone is found in fruits. Cadabicilone is a constituent of the famine food Cadaba farinosa (luqata sigmama). Constituent of the famine food Cadaba farinosa (luqata sigmama). Cadabicilone is found in fruits.

   

(3beta,6beta)-Furanoeremophilane-3,6-diol

3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4,6-diol

C15H22O3 (250.1568862)


(3beta,6beta)-Furanoeremophilane-3,6-diol is found in giant butterbur. (3beta,6beta)-Furanoeremophilane-3,6-diol is a constituent of Petasites japonicus (sweet coltsfoot) Constituent of Petasites japonicus (sweet coltsfoot). Furanofukinol is found in giant butterbur and green vegetables.

   

3-Hydroxytrichothecene

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-10-ol

C15H22O3 (250.1568862)


3-Hydroxytrichothecene is isolated from Fusarium sp. Dec. produced of Trichotriol JXX63-DJXX63-D

   

Heliannuol A

2,2,6,9-tetramethyl-3,4,5,6-tetrahydro-2H-1-benzoxocine-3,8-diol

C15H22O3 (250.1568862)


Heliannuol A is found in fats and oils. Heliannuol A is a constituent of Helianthus annuus (sunflower). Constituent of Helianthus annuus (sunflower). Heliannuol A is found in sunflower and fats and oils.

   

Heliannuol D

2-(2-hydroxypropan-2-yl)-5,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol

C15H22O3 (250.1568862)


Heliannuol D is found in fats and oils. Heliannuol D is a constituent of Helianthus annuus (sunflower) Constituent of Helianthus annuus (sunflower). Heliannuol D is found in sunflower and fats and oils.

   

3beta-Hydroxycinnamolide

7-hydroxy-6,6,9a-trimethyl-1H,3H,5H,5aH,6H,7H,8H,9H,9aH,9bH-naphtho[1,2-c]furan-3-one

C15H22O3 (250.1568862)


3beta-Hydroxycinnamolide is found in mushrooms. 3beta-Hydroxycinnamolide is a constituent of Marasmius oreades (fairy ring mushroom). Constituent of Marasmius oreades (fairy ring mushroom). 3beta-Hydroxycinnamolide is found in mushrooms.

   

FS4 toxin

4-(4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl)-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

C15H22O3 (250.1568862)


FS4 toxin is from Fusarium sporotrichioides and Fusarium sambucinum. From Fusarium sporotrichioides and Fusarium sambucinum

   

3-Ketoapotrichothecene

3a-(hydroxymethyl)-6,8a,8b-trimethyl-3,4a,7,8-tetrahydro-1H-cyclopenta[b][1]benzofuran-2-one

C15H22O3 (250.1568862)


3-Ketoapotrichothecene is a mycotoxin from Fusarium sambucinum. Mycotoxin from Fusarium sambucinum

   

3beta-Dihydroxymarasmene

5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-en-4-ol

C15H22O3 (250.1568862)


3beta-Dihydroxymarasmene is found in mushrooms. 3beta-Dihydroxymarasmene is a metabolite of Marasmius oreades (fairy ring mushroom

   

(3beta,8beta)-3-Hydroxy-7(11)-eremophilen-12,8-olide

6-hydroxy-3,4a,5-trimethyl-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

C15H22O3 (250.1568862)


(3beta,8beta)-3-Hydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables. (3beta,8beta)-3-Hydroxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 3b-Hydroxy-7(11)-eremophilen-12,8b-olide is found in green vegetables.

   

1-Hydroxyacorenone

1-hydroxy-4,8-dimethyl-1-(propan-2-yl)spiro[4.5]dec-8-ene-2,7-dione

C15H22O3 (250.1568862)


1-Hydroxyacorenone is found in herbs and spices. 1-Hydroxyacorenone is a constituent of Acorus calamus (sweet flag) Constituent of Acorus calamus (sweet flag). 1-Hydroxyacorenone is found in herbs and spices and root vegetables.

   

Ethylhexyl salicylate

2-Ethylhexyl 2-hydroxybenzoic acid

C15H22O3 (250.1568862)


Ethylhexyl salicylate, or octyl salicylate, is an organic compound used as an ingredient in sunscreens and cosmetics to absorb UVB (ultraviolet) rays from the sun. It is an ester formed by the condensation of a salicylic acid with 2-ethylhexanol. It is a colorless oily liquid with a slight floral odor.

   

3,5-Di-tert-butyl-4-hydroxybenzoic acid

3,5-Bis(1,1-dimethylethyl)-4-hydroxybenzoic acid

C15H22O3 (250.1568862)


3,5-Di-tert-butyl-4-hydroxybenzoic acid, also known as BHT-COOH or 4-carboxy-2,6-di-tert-butylphenol, belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. Hydroxybenzoic acid derivatives are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups. BHT-COOH 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-OH was detected in human urine (PMID: 31265952). D010592 - Pharmaceutic Aids > D011310 - Preservatives, Pharmaceutical > D010226 - Parabens

   

1-Dodecanesulfonic acid

Dodecylsulfonic acid, sodium salt

C12H26O3S (250.1602566)


   

Naepaine

2-(pentylamino)ethyl 4-aminobenzoate

C14H22N2O2 (250.1681192)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

Nardosinone

1,1,9,9a-tetramethyl-1H,3aH,4H,5H,7H,8H,9H,9aH,9bH-naphtho[2,1-c][1,2]dioxol-5-one

C15H22O3 (250.1568862)


   

Ipomoeamarone

1-[5-(furan-3-yl)-2-methyloxolan-2-yl]-4-methylpentan-2-one

C15H22O3 (250.1568862)


Ipomoeamarone, also known as ipomeamarone, (2r-cis)-isomer or ngaione, is a member of the class of compounds known as heteroaromatic compounds. Heteroaromatic compounds are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom. Ipomoeamarone is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Ipomoeamarone can be found in sweet potato, which makes ipomoeamarone a potential biomarker for the consumption of this food product.

   

5-Hydroxyprocurcumenol

(3S,3aR,8aS)-3,3a-dihydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one

C15H22O3 (250.1568862)


5-hydroxyprocurcumenol is a member of the class of compounds known as guaianes. Guaianes are sesquiterpenoids with a structure based on the guaiane skeleton. Guaiane is a bicyclic compound consisting of a decahydroazulene moiety, substituted with two methyl groups and a 1-methylethyl group at the 1-, 4-, and 7-position, respectively. 5-hydroxyprocurcumenol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 5-hydroxyprocurcumenol can be found in turmeric, which makes 5-hydroxyprocurcumenol a potential biomarker for the consumption of this food product.

   

Dihydroparthenolide

(8E)-4,9,12-trimethyl-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-8-en-13-one

C15H22O3 (250.1568862)


Dihydroparthenolide is a member of the class of compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Dihydroparthenolide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Dihydroparthenolide can be found in sweet bay, which makes dihydroparthenolide a potential biomarker for the consumption of this food product.

   

Nardosinone

5H-Naphtho[2,1-c][1,2]dioxol-5-one, 1,3a,4,7,8,9,9a,9b-octahydro-1,1,9,9a-tetramethyl-, [3aR-(3aalpha,9alpha,9aalpha,9balpha)]-

C15H22O3 (250.1568862)


Nardosinone is a natural product found in Nardostachys jatamansi with data available. Nardosinone, isolated from Nardostachys chinensis, is the first enhancer of the neuritogenic action of dbcAMP and staurosporine. Nardosinone may become a useful pharmacological tool for studying the mechanism of action of not only nerve growth factor (NGF) but also both the neuritogenic substances[1]. Nardosinone, isolated from Nardostachys chinensis, is the first enhancer of the neuritogenic action of dbcAMP and staurosporine. Nardosinone may become a useful pharmacological tool for studying the mechanism of action of not only nerve growth factor (NGF) but also both the neuritogenic substances[1].

   

Carabrol

(3aR,4aS,5S,5aR,6aR)-5-(3-Hydroxybutyl)-5a-methyl-3-methyleneoctahydro-2H-cyclopropa[f][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

9beta-Hydroxycostic acid

[2S-(2alpha,4alpha,4aalpha,8abeta)]-Decahydro-4-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   

6beta-Hydroxyisodrimenin

6beta-Hydroxyisodrimenin

C15H22O3 (250.1568862)


   
   
   

Furandiol

Furandiol(sesquiterpene)

C15H22O3 (250.1568862)


   
   

(-)-Perillup ketol

(-)-Perillup ketol

C15H22O3 (250.1568862)


   

Dihydropseudoivalin

Dihydropseudoivalin

C15H22O3 (250.1568862)


   
   
   
   

[4aR-(4aalpha,5alpha,8aalpha,9aalpha)]- 4a,5,6,7,8,8a,9,9a-Octahydro-8a-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one

[4aR-(4aalpha,5alpha,8aalpha,9aalpha)]- 4a,5,6,7,8,8a,9,9a-Octahydro-8a-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one

C15H22O3 (250.1568862)


   

Jackson ketol, TMS

Jackson ketol, TMS

C15H22O3 (250.1568862)


   

Artesin

[3S-(3alpha,3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

[1R-[1a(Z),6b]]-2-Methyl-3-methyl-6-(1-methylethyl)-2-oxo-3-cyclohexen-1-yl ester

[1R-[1a(Z),6b]]-2-Methyl-3-methyl-6-(1-methylethyl)-2-oxo-3-cyclohexen-1-yl ester

C15H22O3 (250.1568862)


   

2-Hydroxyisocostic acid

2-Hydroxyisocostic acid

C15H22O3 (250.1568862)


   
   
   
   

Longipin-2-ene-7beta,9alpha-diol-1-one

Longipin-2-ene-7beta,9alpha-diol-1-one

C15H22O3 (250.1568862)


   
   

7-Hydroxy-10-dehydroxydeacetyldihydrobotrydial-1(10),5(9)-diene

7-Hydroxy-10-dehydroxydeacetyldihydrobotrydial-1(10),5(9)-diene

C15H22O3 (250.1568862)


   
   
   

[2R-(2alpha,4aalpha,5beta,8abeta)]-Decahydro-5-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid

[2R-(2alpha,4aalpha,5beta,8abeta)]-Decahydro-5-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   
   

dihydrosantamarin

11beta,13-Dihydrosantamarin

C15H22O3 (250.1568862)


   
   
   
   

5-Bromo-2,3-dihydroxy-6-methoxybenzaldehyde

5-Bromo-2,3-dihydroxy-6-methoxybenzaldehyde

C15H22O3 (250.1568862)


   
   
   
   

Macrophyllic acid D

(-)-Macrophyllic acid D

C15H22O3 (250.1568862)


   

[1S-(1alpha,4alpha,4aalpha,8aalpha)]-1,3,4,4a,5,8a-Hexahydro-1-hydroxy-4,7-dimethyl-1-(1-methylethyl)-2,6-naphthalenedione

[1S-(1alpha,4alpha,4aalpha,8aalpha)]-1,3,4,4a,5,8a-Hexahydro-1-hydroxy-4,7-dimethyl-1-(1-methylethyl)-2,6-naphthalenedione

C15H22O3 (250.1568862)


   
   
   

7-Isobutyryloxythymol methyl ether

7-Isobutyryloxythymol methyl ether

C15H22O3 (250.1568862)


   

1-Hydroxymirabolide

1-Hydroxymirabolide

C15H22O3 (250.1568862)


   
   

Myoporon

(S)-1-(3-Furanyl)-4,8-dimethyl-1,6-nonanedione

C15H22O3 (250.1568862)


   

11S,13-Dihydrotessaric acid

[2R-[2alpha(S*),8alpha,8aalpha]]-1,2,3,4,6,7,8,8a-Octahydro-alpha,8,8a-trimethyl-6-oxo-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   
   

2-Deacetoxy-11beta,13-dihydroxanthinin

2-Deacetoxy-11beta,13-dihydroxanthinin

C15H22O3 (250.1568862)


   
   
   

12-Hydroxy-4,11(13)-cadinadien-15-oic acid

12-Hydroxy-4,11(13)-cadinadien-15-oic acid

C15H22O3 (250.1568862)


   

Dihydroreynosin

[3S-(3alpha,3aalpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-6-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

Artepaulin

[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione

C15H22O3 (250.1568862)


   

Herbolide G

[3S-(3alpha,3aalpha,5beta,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-5-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

Heterophyllol

(4alpha,4aalpha,7alpha)-(+)-4,4a,5,6,7,8-hexahydro-4-hydroxy-7-[1-(hydroxymethyl)ethenyl]-1,4a-dimethyl-2(3H)-naphthalenone

C15H22O3 (250.1568862)


   
   
   

Versicolactone B

Versicolactone B

C15H22O3 (250.1568862)


A sesquiterpene lactone with formula C15H22O3 that is isolated from Viola yedoensis and Aristolochia versicolor.

   

Furoscrobiculin D

Furoscrobiculin D

C15H22O3 (250.1568862)


   

Lychnopholic acid

Lychnophorolic acid

C15H22O3 (250.1568862)


   
   

Cantabrenolic acid

Cantabrenolic acid

C15H22O3 (250.1568862)


   

2beta-Hydroxy-9,11(13)-eremophiladien-12-oic acid

[2R-(2alpha,6alpha,8alpha,8aalpha)]-1,2,3,5,6,7,8,8a-octahydro-6-hydroxy-8,8a-dimethyl-alpha-methylene-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   

Septuplinolide

[3aR-(3aalpha,4aalpha,5beta,8abeta,9aalpha)]-Decahydro-5-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

Cheimonophyllon D

Cheimonophyllon D

C15H22O3 (250.1568862)


   

Artedouglasia oxide B

Artedouglasia oxide B

C15H22O3 (250.1568862)


   
   

(1R,4R)-4-Hydroxydauca-7-ene-6-one

(+)-(1R,4R)-4-Hydroxydauca-7-ene-6-one

C15H22O3 (250.1568862)


   
   
   

Dihydroparthenolide

11beta,13-Dihydroparthenolide

C15H22O3 (250.1568862)


   
   

Roridin C

12,13-Epoxy-trichothec-9-en-4beta-ol

C15H22O3 (250.1568862)


   

[2R-(2alpha,4aalpha,7alpha)]-1,2,3,4,4a,5,6,7-Octahydro-7-hydroxy-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid

[2R-(2alpha,4aalpha,7alpha)]-1,2,3,4,4a,5,6,7-Octahydro-7-hydroxy-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   

Porellapinguisenone

Porellapinguisenone

C15H22O3 (250.1568862)


   

Macrophyllic acid B

(-)-Macrophyllic acid B

C15H22O3 (250.1568862)


   

Vernopolyanthofuran

Vernopolyanthofuran

C15H22O3 (250.1568862)


   

Viscic acid

[2R-(2alpha,4aalpha,7beta,8abeta)]-Decahydro-7-hydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   

Lychnosalicifolide

Lychnosalicifolide

C15H22O3 (250.1568862)


   

3beta-Hydroxy-9,11(13)-eremophiladien-12-oic acid

[2R-(2alpha,7alpha,8alpha,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-7-hydroxy-8,8a-dimethyl-alpha-methylene-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   

Aikupikanyne A

Aikupikanyne A

C19H22 (250.1721412)


   

Schizandronol 8,13beta-oxide

Schizandronol 8,13beta-oxide

C15H22O3 (250.1568862)


   
   
   

4-Dihydrotomentosin

4-Dihydrotomentosin

C15H22O3 (250.1568862)


   

Cybrodol

(E)-4-(Hydroxymethyl)-3-(3-hydroxy-2-methyl-1-propenyl)-2,6-dimethyl-benzeneethanol

C15H22O3 (250.1568862)


   
   

7-Oxodihydrodrimenin

7-Oxodihydrodrimenin

C15H22O3 (250.1568862)


   

3beta-Hydroxy-4beta,15,11a,13-tetrahydrodehydrocostuslactone

3beta-Hydroxy-4beta,15,11a,13-tetrahydrodehydrocostuslactone

C15H22O3 (250.1568862)


   

Lychnocolumnic acid

(1R*,3Z,7E,11R*)-(-)-7,10,10-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-3-carboxylic acid

C15H22O3 (250.1568862)


   

Dihydrohypnophilin

(+)-Dihydrohypnophilin

C15H22O3 (250.1568862)


   

[3R-(3alpha,3aalpha,5alpha,6beta,7aalpha)]-6-Ethenylhexahydro-5-[1-(hydroxymethyl)ethenyl]-3,6-dimethyl-(3H)-benzofuranone

[3R-(3alpha,3aalpha,5alpha,6beta,7aalpha)]-6-Ethenylhexahydro-5-[1-(hydroxymethyl)ethenyl]-3,6-dimethyl-(3H)-benzofuranone

C15H22O3 (250.1568862)


   
   

Epoxypavinolide

Decahydro-7,7,9a-trimethyl-4-methylene-6H-Oxireno[5,6]cyclonona[1,2-b]furan-6-one

C15H22O3 (250.1568862)


   

(1S,3R,4S)-Calamenene-3,4,7-triol

(1S,3R,4S)-Calamenene-3,4,7-triol

C15H22O3 (250.1568862)


   

Sambucoin

[3aS-(3aalpha,5aalpha,9abeta,9balpha)]-1,3a,4,5a,8,9,9a,9b-Octahydro-3a-hydroxy-7,9a,9b-trimethycyclopenta[c][1]benzopyran-3(2H)-one

C15H22O3 (250.1568862)


   
   
   
   
   

6-Hydroxy-14-sesquilimonenoic acid

6-Hydroxy-14-sesquilimonenoic acid

C15H22O3 (250.1568862)


   

9alpha-Hydroxycinnamolide

9alpha-Hydroxycinnamolide

C15H22O3 (250.1568862)


   

trans-(+)-3,4,4a,5,6,7,8,8a-Octahydro-5,5,8a-trimethyl-3-oxo-2-naphthalenecarboxylic acid methyl ester

trans-(+)-3,4,4a,5,6,7,8,8a-Octahydro-5,5,8a-trimethyl-3-oxo-2-naphthalenecarboxylic acid methyl ester

C15H22O3 (250.1568862)


   
   

1beta,10beta-Epoxyeremophil-11(13)-en-12-oic acid

1beta,10beta-Epoxyeremophil-11(13)-en-12-oic acid

C15H22O3 (250.1568862)


   
   

Dihydroarteannuin B

Dihydroarteannuin B

C15H22O3 (250.1568862)


   

3alpha-Hydroxyfuroepaltol

[4aR-(4aalpha,5alpha,6alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-5,6-diol

C15H22O3 (250.1568862)


   
   

Flourensic acid

9-Oxo-7xi-eremophil-11(13)-en-12-oic acid

C15H22O3 (250.1568862)


   
   

3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide

(+)-3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide

C15H22O3 (250.1568862)


   
   

10alpha,14H-1-epi-Inuviscolide

10alpha,14H-1-epi-Inuviscolide

C15H22O3 (250.1568862)


   

11-Hydroxydehydrobotrydienol

(-)-11-Hydroxydehydrobotrydienol

C15H22O3 (250.1568862)


   
   
   

4,8-Dihydroxylactariusfuran

4,8-Dihydroxylactariusfuran

C15H22O3 (250.1568862)


   

cis-1,2,3,4,4a,5,6,7-Octahydro-8-(hydroxymethyl)-4a-methyl-alpha-methylene-2-naphthaleneacetic acid

cis-1,2,3,4,4a,5,6,7-Octahydro-8-(hydroxymethyl)-4a-methyl-alpha-methylene-2-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   

2,4-Dimethyl-2,6-bis(hydroxymethyl)indan-5-ethanol

2,4-Dimethyl-2,6-bis(hydroxymethyl)indan-5-ethanol

C15H22O3 (250.1568862)


   

12-Hydroxydehydrobotrydienol

(+)-12-Hydroxydehydrobotrydienol

C15H22O3 (250.1568862)


   
   
   

3beta-Hydroxy-11beta,13-dihydro-desoxo-achalensolide

3beta-Hydroxy-11beta,13-dihydro-desoxo-achalensolide

C15H22O3 (250.1568862)


   
   

11,13-Epoxy-4-cadinen-15-oic acid

11,13-Epoxy-4-cadinen-15-oic acid

C15H22O3 (250.1568862)


   

Methyl montiporate A

Methyl montiporate A

C15H22O3 (250.1568862)


   

9beta-Acetoxyeudesma-4,11(13)-dien-12-oic acid

9beta-Acetoxyeudesma-4,11(13)-dien-12-oic acid

C15H22O3 (250.1568862)


   
   

3-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-5-hydroxy-2(5H)-furanone

3-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-5-hydroxy-2(5H)-furanone

C15H22O3 (250.1568862)


   
   

2-Deoxy-12-oxolemnacarnol

2-Deoxy-12-oxolemnacarnol

C15H22O3 (250.1568862)


   

10,12-Dihydroxy-3-longipinen-5-one

10,12-Dihydroxy-3-longipinen-5-one

C15H22O3 (250.1568862)


   
   
   

12-Hydroxy-4,11(13)-muuroladien-15-oic acid

12-Hydroxy-4,11(13)-muuroladien-15-oic acid

C15H22O3 (250.1568862)


   

Pentalenic acid

Pentalenic acid

C15H22O3 (250.1568862)


A tricyclic sesquiterpenoid that is pentalenene in which the 13-methyl group is oxidsed to the carboxylic acid and position 1 is substituted by a hydroxy group.

   

Macrophyllic acid C

(+)-Macrophyllic acid C

C15H22O3 (250.1568862)


   

Macrophyllic acid E

(+)-Macrophyllic acid E

C15H22O3 (250.1568862)


   

11-epi-Dihydroreynosin

11alpha,13-Dihydroreynosin

C15H22O3 (250.1568862)


   

1-DODECANESULFONIC ACID

1-DODECANESULFONIC ACID

C12H26O3S (250.1602566)


   

Lidocaine N-oxide

Lidocaine N-oxide

C14H22N2O2 (250.1681192)


CONFIDENCE Transformation product with Reference Standard (Level 1); INTERNAL_ID 801 INTERNAL_ID 801; CONFIDENCE Transformation product with Reference Standard (Level 1) CONFIDENCE standard compound; EAWAG_UCHEM_ID 3279 CONFIDENCE standard compound; INTERNAL_ID 2114

   

Acetamide, 2-(diethylamino)-N-(4-hydroxy-2,6-dimethylphenyl)-

Acetamide, 2-(diethylamino)-N-(4-hydroxy-2,6-dimethylphenyl)-

C14H22N2O2 (250.1681192)


   
   

Desoxyarbusculin D

Desoxyarbusculin D

C15H22O3 (250.1568862)


   

12-hydroxycamoensidine

12-hydroxycamoensidine

C14H22N2O2 (250.1681192)


   
   

(+)-3beta-hydroxyconfertifolin|3beta-hydroxyconfertifolin

(+)-3beta-hydroxyconfertifolin|3beta-hydroxyconfertifolin

C15H22O3 (250.1568862)


   
   

9-hydroxy-curcuhydroquinone

9-hydroxy-curcuhydroquinone

C15H22O3 (250.1568862)


   

(11S)-5,6alpha-epoxy-8beta-hydroxy-eudesman-12-oic acid-lactone|(11S)-5,6alpha-Epoxy-8beta-hydroxy-eudesman-12-saeure-lacton|5alpha,6alpha-epoxyeudesm-12,8beta-lactone

(11S)-5,6alpha-epoxy-8beta-hydroxy-eudesman-12-oic acid-lactone|(11S)-5,6alpha-Epoxy-8beta-hydroxy-eudesman-12-saeure-lacton|5alpha,6alpha-epoxyeudesm-12,8beta-lactone

C15H22O3 (250.1568862)


   

(-)-10-oxo-isodauc-3-en-15-oic acid

(-)-10-oxo-isodauc-3-en-15-oic acid

C15H22O3 (250.1568862)


   

1beta-hydroxy-4beta,5alpha,8beta(H)-eudesm-7(11)Z-en-12,8-olide|chlospicate B

1beta-hydroxy-4beta,5alpha,8beta(H)-eudesm-7(11)Z-en-12,8-olide|chlospicate B

C15H22O3 (250.1568862)


   
   
   
   

15-hydroxyisocostic acid

15-hydroxyisocostic acid

C15H22O3 (250.1568862)


   
   
   

coprinolone ketodiol

coprinolone ketodiol

C15H22O3 (250.1568862)


   
   
   

7-dehydroxyzinniol

7-dehydroxyzinniol

C15H22O3 (250.1568862)


   

(E)-3-((5S,7S,7aS)-3-(hydroxymethyl)-7-methyl-2,4,5,6,7,7a-hexahydro-1H-inden-5-yl)-2-methylacrylic acid|nardin B

(E)-3-((5S,7S,7aS)-3-(hydroxymethyl)-7-methyl-2,4,5,6,7,7a-hexahydro-1H-inden-5-yl)-2-methylacrylic acid|nardin B

C15H22O3 (250.1568862)


   

Antibiotic JBIR 27

6-Hydroxy-4a-(hydroxymethyl)-3-isopropenyl-5-methyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone

C15H22O3 (250.1568862)


   
   

dihydrosporogen-AO 1|protopine

dihydrosporogen-AO 1|protopine

C15H22O3 (250.1568862)


   
   

(3S,3aR,4aR,5R,8aR,9aR)-3,8a-dimethyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2-oxiran]-2-one

(3S,3aR,4aR,5R,8aR,9aR)-3,8a-dimethyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2-oxiran]-2-one

C15H22O3 (250.1568862)


   

2S,4S,5R,7R,8R,11S-2-hydroxyeremophil-1(10)-en-12,8-olide|sibiriolide D

2S,4S,5R,7R,8R,11S-2-hydroxyeremophil-1(10)-en-12,8-olide|sibiriolide D

C15H22O3 (250.1568862)


   

11-hydroxyguai-4(5)-ene-3,6-dione|Melicodenone D

11-hydroxyguai-4(5)-ene-3,6-dione|Melicodenone D

C15H22O3 (250.1568862)


   
   

(1R,3R,8S,E)-8,12-epoxy-1,6-cyclofarnesa-4,6,9-triene-3,11-diol

(1R,3R,8S,E)-8,12-epoxy-1,6-cyclofarnesa-4,6,9-triene-3,11-diol

C15H22O3 (250.1568862)


   

6,6,9a-Trimethyl-decahydronaphtho[1,2-c]furan-1,4-dione

6,6,9a-Trimethyl-decahydronaphtho[1,2-c]furan-1,4-dione

C15H22O3 (250.1568862)


   

1,2-dehydrocarrissonol|11,15-dihydroxy-7alphaH-eudesma-1,4-diene-3-one

1,2-dehydrocarrissonol|11,15-dihydroxy-7alphaH-eudesma-1,4-diene-3-one

C15H22O3 (250.1568862)


   
   
   

(3S?,3aR?,5E,10S?,11aR?)-6,10,12-trimethyl-3,3a,4,7,8,9,10,11,11a,12-decahydro-cyclodeca[b]furan-2,7-dione|(4E,7R?,8R?,10S?,11S?)-3-oxo-germacr-4-en-8beta-12-olide|inuloxin B

(3S?,3aR?,5E,10S?,11aR?)-6,10,12-trimethyl-3,3a,4,7,8,9,10,11,11a,12-decahydro-cyclodeca[b]furan-2,7-dione|(4E,7R?,8R?,10S?,11S?)-3-oxo-germacr-4-en-8beta-12-olide|inuloxin B

C15H22O3 (250.1568862)


   

(-)-3beta,4beta-epoxyvalerenic acid

(-)-3beta,4beta-epoxyvalerenic acid

C15H22O3 (250.1568862)


   
   

8-deoxy-4a-hydroxytsugicoline

8-deoxy-4a-hydroxytsugicoline

C15H22O3 (250.1568862)


   

2-Isopropyl-4-methoxy-5-methylphenyl isobutyrate

2-Isopropyl-4-methoxy-5-methylphenyl isobutyrate

C15H22O3 (250.1568862)


   

4E-9beta-hydroxy-7alpha,10alphaH-germacra-4,11(13)-dien-12,6alpha-olide

4E-9beta-hydroxy-7alpha,10alphaH-germacra-4,11(13)-dien-12,6alpha-olide

C15H22O3 (250.1568862)


   
   
   

(1R,6S,7R)-(+)-11-hydroxysclerosporin

(1R,6S,7R)-(+)-11-hydroxysclerosporin

C15H22O3 (250.1568862)


   

4-Oxo-1-methoxycarbonyl-5,5-dimethyl-6alpha,7alpha-ethano-trans-hydrindan

4-Oxo-1-methoxycarbonyl-5,5-dimethyl-6alpha,7alpha-ethano-trans-hydrindan

C15H22O3 (250.1568862)


   

(2beta, 3beta)-Furanoeremophilane-2, 3-diol

(2beta, 3beta)-Furanoeremophilane-2, 3-diol

C15H22O3 (250.1568862)


   

4alpha,15-Epoxycostic acid

4alpha,15-Epoxycostic acid

C15H22O3 (250.1568862)


   

2,2,4,6-tetramethyl-2,3,6,7-tetrahydrospiro[cyclopropane-1,5-indene]-3,6,7-triol

2,2,4,6-tetramethyl-2,3,6,7-tetrahydrospiro[cyclopropane-1,5-indene]-3,6,7-triol

C15H22O3 (250.1568862)


   

10beta-hydroxy-11beta,13-dihydrocichopumilode

10beta-hydroxy-11beta,13-dihydrocichopumilode

C15H22O3 (250.1568862)


   

8alpha-hydroxy-13-oxospathulenol

8alpha-hydroxy-13-oxospathulenol

C15H22O3 (250.1568862)


   
   

11,13-Dihydroivalin

11,13-Dihydroivalin

C15H22O3 (250.1568862)


   
   

6H-Oxireno[5,6]cyclonona[1,2-b]furan-6-one, decahydro-7,7,9a-trimethyl-4-methylene-

6H-Oxireno[5,6]cyclonona[1,2-b]furan-6-one, decahydro-7,7,9a-trimethyl-4-methylene-

C15H22O3 (250.1568862)


   

tomentosin|xanthalongin

tomentosin|xanthalongin

C15H22O3 (250.1568862)


   

3a-Hydroxy-7,9a,9b-trimethyl-1,3a,4,5a,8,9,9a,9b-octahydrocyclopenta[c]chromen-3(2H)-one #

3a-Hydroxy-7,9a,9b-trimethyl-1,3a,4,5a,8,9,9a,9b-octahydrocyclopenta[c]chromen-3(2H)-one #

C15H22O3 (250.1568862)


   

mukaadial|polygodial

mukaadial|polygodial

C15H22O3 (250.1568862)


   

2-(5-ethenyltetrahydro-5-methyl-2-furanyl)-5-hydroxy-6-methyl-4,6-heptadien-3-one

2-(5-ethenyltetrahydro-5-methyl-2-furanyl)-5-hydroxy-6-methyl-4,6-heptadien-3-one

C15H22O3 (250.1568862)


   

(1aalpha,2beta,3beta,7alpha,7aalpha,7balpha)-1,1a,2,3,6,7,7a,7b-octahydro-2,3-dihydroxy-1,1,7,7a-tetramethyl-5H-cyclopropa[a]naphthalen-5-one|rulepidadiol

(1aalpha,2beta,3beta,7alpha,7aalpha,7balpha)-1,1a,2,3,6,7,7a,7b-octahydro-2,3-dihydroxy-1,1,7,7a-tetramethyl-5H-cyclopropa[a]naphthalen-5-one|rulepidadiol

C15H22O3 (250.1568862)


   

15-hydroxy-3-epiisopetasol

15-hydroxy-3-epiisopetasol

C15H22O3 (250.1568862)


   
   

3,6,9,12,15-Pentaoxaheptadecane

3,6,9,12,15-Pentaoxaheptadecane

C12H26O5 (250.17801459999998)


   

8alpha-hydroxy-1alpha,4alpha,5alpha,11betaH-guaia-10(14)-en-12,6alpha-olide

8alpha-hydroxy-1alpha,4alpha,5alpha,11betaH-guaia-10(14)-en-12,6alpha-olide

C15H22O3 (250.1568862)


   

4-(5-Hydroxy-4,8-dimethyl-3,7-nonadienyl)-2(5H)-furanone|8-hydroxy-3,7,11-trimethyl-2Z,6E,10-dodecatrien-13,1-olide

4-(5-Hydroxy-4,8-dimethyl-3,7-nonadienyl)-2(5H)-furanone|8-hydroxy-3,7,11-trimethyl-2Z,6E,10-dodecatrien-13,1-olide

C15H22O3 (250.1568862)


   

5alpha-Hydroxy-beta-costic acid|5alpha-hydroxyisocostic acid

5alpha-Hydroxy-beta-costic acid|5alpha-hydroxyisocostic acid

C15H22O3 (250.1568862)


   

2-Hydroxyguia-1(10),11-dien-15-oic acid

2-Hydroxyguia-1(10),11-dien-15-oic acid

C15H22O3 (250.1568862)


   

dihydroxypenlanfuran

dihydroxypenlanfuran

C15H22O3 (250.1568862)


   

3alpha-hydroxy-bakkenolide A

3alpha-hydroxy-bakkenolide A

C15H22O3 (250.1568862)


   

7alpha,11alpha-epoxy-5beta-hydroxy-9-guaiaen-8-one|7alpha,11alpha-epoxy-beta-hydroxy-9-guaiaen-8-one|oxycurcumenol epoxide

7alpha,11alpha-epoxy-5beta-hydroxy-9-guaiaen-8-one|7alpha,11alpha-epoxy-beta-hydroxy-9-guaiaen-8-one|oxycurcumenol epoxide

C15H22O3 (250.1568862)


   
   

15-Hydroxy-3,11(13)-eudesmadien-12-oic acid

15-Hydroxy-3,11(13)-eudesmadien-12-oic acid

C15H22O3 (250.1568862)


   

(3R,4R,4aR,9R)-3,9-dihydroxy-1,4,4a,7-tetramethyl-3,4,4a,5,8,9-hexahydro-2H-benzo[a]cyclohepten-2-one|9-hydroxy-3-epi-perforenone A

(3R,4R,4aR,9R)-3,9-dihydroxy-1,4,4a,7-tetramethyl-3,4,4a,5,8,9-hexahydro-2H-benzo[a]cyclohepten-2-one|9-hydroxy-3-epi-perforenone A

C15H22O3 (250.1568862)


   

(6alpha,8alpha,11betaH)-6-Hydroxy-4(15)-eudesmen-12,8-olide

(6alpha,8alpha,11betaH)-6-Hydroxy-4(15)-eudesmen-12,8-olide

C15H22O3 (250.1568862)


   

3E,6E,10E-humulatrien-1alpha,8alpha-diol-5-one|mitissimol C

3E,6E,10E-humulatrien-1alpha,8alpha-diol-5-one|mitissimol C

C15H22O3 (250.1568862)


   
   

1alpha-hydroxy-11,13-dihydroisoalantolactone

1alpha-hydroxy-11,13-dihydroisoalantolactone

C15H22O3 (250.1568862)


   
   
   

9alpha-hydroperoxy-1(10)-aristolenone-(2)

9alpha-hydroperoxy-1(10)-aristolenone-(2)

C15H22O3 (250.1568862)


   

11(13)-Dihydro-4alpha,5beta-epoxy-8-epi-inunolide

11(13)-Dihydro-4alpha,5beta-epoxy-8-epi-inunolide

C15H22O3 (250.1568862)


   

rel-(1R,3S,5aS,6R,8R,8aR,8bR)-1,2,3,5,5a,6,7,8,8a,8b-decahydro-3,6-dimethyl-2-methylene-as-indacene-1,3,8-triol|stereumin F

rel-(1R,3S,5aS,6R,8R,8aR,8bR)-1,2,3,5,5a,6,7,8,8a,8b-decahydro-3,6-dimethyl-2-methylene-as-indacene-1,3,8-triol|stereumin F

C15H22O3 (250.1568862)


   

10,11-epoxy-3E,6E-humuladien-1alpha-ol-5-one|mitissimol B

10,11-epoxy-3E,6E-humuladien-1alpha-ol-5-one|mitissimol B

C15H22O3 (250.1568862)


   
   
   

11,13-dihydropechueloic acid

11,13-dihydropechueloic acid

C15H22O3 (250.1568862)


   
   

13-Hydroxypetasol

13-Hydroxypetasol

C15H22O3 (250.1568862)


   
   

2-Oxoisocostic acid

2-Oxoisocostic acid

C15H22O3 (250.1568862)


   

2-(isobutyryloxy)thymol methyl ether

2-(isobutyryloxy)thymol methyl ether

C15H22O3 (250.1568862)


   

3-deoxylactarorufin A|3-Desoxylactarorufin A

3-deoxylactarorufin A|3-Desoxylactarorufin A

C15H22O3 (250.1568862)


   

(3??,7alpha,7??H)-3,7-Dihydroxy-9,11-eremophiladien-8-one|(7S)-7-Hydroxypetasol

(3??,7alpha,7??H)-3,7-Dihydroxy-9,11-eremophiladien-8-one|(7S)-7-Hydroxypetasol

C15H22O3 (250.1568862)


   

13,14-dihydroxyaromadendr-1(10)-en-9-one

13,14-dihydroxyaromadendr-1(10)-en-9-one

C15H22O3 (250.1568862)


   

(1??,3alpha,7??H)-1,3-Dihydroxy-9,11-eremophiladien-8-one|1-Hydroxypetasol|1b-hydroxypetasol

(1??,3alpha,7??H)-1,3-Dihydroxy-9,11-eremophiladien-8-one|1-Hydroxypetasol|1b-hydroxypetasol

C15H22O3 (250.1568862)


   

(alphaR,1R,4R,4aS,8aS)-1,2,3,4,4a,5,8,8a-Octahydro-alpha,4,7-trimethyl-8-oxo-1-naphthaleneacetic acid

(alphaR,1R,4R,4aS,8aS)-1,2,3,4,4a,5,8,8a-Octahydro-alpha,4,7-trimethyl-8-oxo-1-naphthaleneacetic acid

C15H22O3 (250.1568862)


   
   

4,6-diene-1beta,15-dihydroxyeudesma-3-one

4,6-diene-1beta,15-dihydroxyeudesma-3-one

C15H22O3 (250.1568862)


   

11alpha,13-dihydro-8-desoxysalonitenolide

11alpha,13-dihydro-8-desoxysalonitenolide

C15H22O3 (250.1568862)


   

9beta-9-Hydroxy-4,11-eudesmadien-15-oic acid

9beta-9-Hydroxy-4,11-eudesmadien-15-oic acid

C15H22O3 (250.1568862)


   

(1R,6S,7R)-(+)-15-hydroxysclerosporin

(1R,6S,7R)-(+)-15-hydroxysclerosporin

C15H22O3 (250.1568862)


   

(7R,9E)-1,2,11-trihydroxy-1,3,5,9-bisabolatetraene|(R,E)-3-(6-hydroxy-6-methylhept-4-en-2-yl)-6-methylbenzene-1,2-diol|6-hydroxy-2-methyl-5-(5-hydroxy-1(R),5-dimethylhex-3-enyl)-phenol

(7R,9E)-1,2,11-trihydroxy-1,3,5,9-bisabolatetraene|(R,E)-3-(6-hydroxy-6-methylhept-4-en-2-yl)-6-methylbenzene-1,2-diol|6-hydroxy-2-methyl-5-(5-hydroxy-1(R),5-dimethylhex-3-enyl)-phenol

C15H22O3 (250.1568862)


   

2-(1,2-dihydroxy-1-methylethyl)-6,10-dimethylspiro<4,5>dec-6,9-dien-8-one

2-(1,2-dihydroxy-1-methylethyl)-6,10-dimethylspiro<4,5>dec-6,9-dien-8-one

C15H22O3 (250.1568862)


   

8,9-secocedrachinol

8,9-secocedrachinol

C15H22O3 (250.1568862)


   

(3beta, 9beta)-Furanoeremophilane-3, 9-diol

(3beta, 9beta)-Furanoeremophilane-3, 9-diol

C15H22O3 (250.1568862)


   

O-(3-Methyl-2-butenoyl)-Ferulol

O-(3-Methyl-2-butenoyl)-Ferulol

C15H22O3 (250.1568862)


   

cosmosane|cosmosoic acid|rel-(4aR,8R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4a-methyl-8-(1-methylethyl)-5-oxonaphthalene-2-carboxylic acid

cosmosane|cosmosoic acid|rel-(4aR,8R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4a-methyl-8-(1-methylethyl)-5-oxonaphthalene-2-carboxylic acid

C15H22O3 (250.1568862)


   

4,15-dihydroxylongipin-9(12)-en-10-one

4,15-dihydroxylongipin-9(12)-en-10-one

C15H22O3 (250.1568862)


   

(4alpha,5alpha)-4-Hydroxy-11(13)-amorphen-12,5-olide|Artemislactone|Quinghaosu V

(4alpha,5alpha)-4-Hydroxy-11(13)-amorphen-12,5-olide|Artemislactone|Quinghaosu V

C15H22O3 (250.1568862)


   

1beta-Hydroxysant-3-en-6.12-olid-C

1beta-Hydroxysant-3-en-6.12-olid-C

C15H22O3 (250.1568862)


   

4,O-dihydroinusoniolide|4-O-dihydroinusoniolide

4,O-dihydroinusoniolide|4-O-dihydroinusoniolide

C15H22O3 (250.1568862)


   

4,5-seco-11(13)-Eudesmen-12,8-olid-4-one

4,5-seco-11(13)-Eudesmen-12,8-olid-4-one

C15H22O3 (250.1568862)


   
   

1beta,10beta-epoxy-11alphaH-eremophylan-12,8beta-olide

1beta,10beta-epoxy-11alphaH-eremophylan-12,8beta-olide

C15H22O3 (250.1568862)


   
   
   

8beta-hydroxy-germacra-1(10),4,11(13)-trien-12-oate

8beta-hydroxy-germacra-1(10),4,11(13)-trien-12-oate

C15H22O3 (250.1568862)


   

Aerugidiol

(3S,3aR,8aR)-3,8a-dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,3a,4-tetrahydroazulen-6-one

C15H22O3 (250.1568862)


Aerugidiol is a natural product found in Curcuma aeruginosa, Curcuma zedoaria, and Curcuma heyneana with data available.

   

5α-Hydroxycostic acid

2-[(4aR,8aR)-8a-hydroxy-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid

C15H22O3 (250.1568862)


5α-Hydroxycostic acid, a eudesmane-type sesquiterpene, is isolated from the herb Laggera alata. 5α-Hydroxycostic acid inhibits angiogenesis and suppresses breast cancer cell migration through regulating VEGF/VEGFR2 and Ang2/Tie2 pathways[1].

   

Tox21_200020

2-Propenoic acid, 3-[(1R,4S,7R,7aR)-2,4,5,6,7,7a-hexahydro-1-hydroxy-3,7-dimethyl-1H-inden-4-yl]-2-methyl-, (2E)-

C15H22O3 (250.1568862)


Hydroxyvalerenic Acid is a natural product found in Valeriana officinalis with data available. See also: Valerian (part of).

   

1,4-Epidioxybisabola-2,10-dien-9-one

(6R)-2-methyl-6-[(1S,4R,5S)-7-methyl-2,3-dioxabicyclo[2.2.2]oct-7-en-5-yl]hept-2-en-4-one

C15H22O3 (250.1568862)


   

gemfibrozil

gemfibrozil

C15H22O3 (250.1568862)


C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065687 - Cytochrome P-450 CYP2C8 Inhibitors C - Cardiovascular system > C10 - Lipid modifying agents > C10A - Lipid modifying agents, plain > C10AB - Fibrates D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites CONFIDENCE standard compound; EAWAG_UCHEM_ID 3071 Gemfibrozil is an activator of PPAR-α, used as a lipid-lowering agent; Gemfibrozil is also a nonselective inhibitor of several P450 isoforms, with Ki values for CYP2C9, 2C19, 2C8, and 1A2 of 5.8, 24, 69, and 82 μM, respectively.

   

C15H22O3_4,7-Methanoazulen-6(1H)-one, 2,4,5,7,8,8a-hexahydro-7-hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-, (1S,4R,7R,8aS)

NCGC00380529-01_C15H22O3_4,7-Methanoazulen-6(1H)-one, 2,4,5,7,8,8a-hexahydro-7-hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-, (1S,4R,7R,8aS)-

C15H22O3 (250.1568862)


   

C15H22O3_2H-Cyclohepta[b]furan-2-one, 3,3a,4,7,8,8a-hexahydro-6-(3-hydroxybutyl)-7-methyl-3-methylene

NCGC00179809-02_C15H22O3_2H-Cyclohepta[b]furan-2-one, 3,3a,4,7,8,8a-hexahydro-6-(3-hydroxybutyl)-7-methyl-3-methylene-

C15H22O3 (250.1568862)


   

Hydroxyvalerenic acid

NCGC00091907-03_C15H22O3_(2E)-3-[(1R,4S,7R,7aR)-1-Hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylacrylic acid

C15H22O3 (250.1568862)


   

C15H22O3_3-Cycloheptene-1-acetic acid, 5-methyl-alpha-methylene-4-(3-oxobutyl)-, (1R,5S)

NCGC00385912-01_C15H22O3_3-Cycloheptene-1-acetic acid, 5-methyl-alpha-methylene-4-(3-oxobutyl)-, (1R,5S)-

C15H22O3 (250.1568862)


   

C15H22O3_Naphtho[2,3-b]furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9a-hydroxy-3,4a,5-trimethyl-, (4aR,5S,8aS,9aR)

NCGC00169029-02_C15H22O3_Naphtho[2,3-b]furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9a-hydroxy-3,4a,5-trimethyl-, (4aR,5S,8aS,9aR)-

C15H22O3 (250.1568862)


   

C15H22O3_(3aR,4aS,5S,5aR,6aR)-5-(3-Hydroxybutyl)-5a-methyl-3-methyleneoctahydro-2H-cyclopropa[f][1]benzofuran-2-one

NCGC00385020-01_C15H22O3_(3aR,4aS,5S,5aR,6aR)-5-(3-Hydroxybutyl)-5a-methyl-3-methyleneoctahydro-2H-cyclopropa[f][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

C15H22O3

NCGC00385428-01_C15H22O3_

C15H22O3 (250.1568862)


   

C15H22O3_3a-Hydroxy-3,5a,9-trimethyl-3a,4,5,5a,6,7,8,9b-octahydronaphtho[1,2-b]furan-2(3H)-one

NCGC00385921-01_C15H22O3_3a-Hydroxy-3,5a,9-trimethyl-3a,4,5,5a,6,7,8,9b-octahydronaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

C15H22O3_2-[(1S,2S,4aR,8aS)-1-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid

NCGC00384653-01_C15H22O3_2-[(1S,2S,4aR,8aS)-1-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid

C15H22O3 (250.1568862)


   

C15H22O3_2-Naphthaleneacetic acid, decahydro-2-hydroxy-4a-methyl-alpha,8-bis(methylene)-, (2S,4aR,8aS)

NCGC00180717-02_C15H22O3_2-Naphthaleneacetic acid, decahydro-2-hydroxy-4a-methyl-alpha,8-bis(methylene)-, (2S,4aR,8aS)-

C15H22O3 (250.1568862)


   

C15H22O3_2-[(2R,4aS,7R)-7-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid

NCGC00180293-02_C15H22O3_2-[(2R,4aS,7R)-7-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid

C15H22O3 (250.1568862)


   

C15H22O3_2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-3,6-dihydroxy-4a,5-dimethyl-3-(1-methylethenyl)-, (3S,4aR,5R,6R)

NCGC00384621-01_C15H22O3_2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-3,6-dihydroxy-4a,5-dimethyl-3-(1-methylethenyl)-, (3S,4aR,5R,6R)-

C15H22O3 (250.1568862)


   

C15H22O3

NCGC00385483-01_C15H22O3_

C15H22O3 (250.1568862)


   

C15H22O3_7,8-Bis(hydroxymethyl)-1,4a-dimethyl-3,4,4a,5,6,7-hexahydro-2H-benzo[7]annulen-2-one

NCGC00380624-01_C15H22O3_7,8-Bis(hydroxymethyl)-1,4a-dimethyl-3,4,4a,5,6,7-hexahydro-2H-benzo[7]annulen-2-one

C15H22O3 (250.1568862)


   

C15H22O3_2-Naphthaleneacetic acid, decahydro-4-hydroxy-4a-methyl-alpha,8-bis(methylene)

NCGC00384956-01_C15H22O3_2-Naphthaleneacetic acid, decahydro-4-hydroxy-4a-methyl-alpha,8-bis(methylene)-

C15H22O3 (250.1568862)


   

C15H22O3_(1aS,2R,6R,7R,7aR,7bR)-1a-Isopropenyl-7,7a-dimethyl-1a,2,4,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxirene-2,6-diol

NCGC00169914-02_C15H22O3_(1aS,2R,6R,7R,7aR,7bR)-1a-Isopropenyl-7,7a-dimethyl-1a,2,4,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxirene-2,6-diol

C15H22O3 (250.1568862)


   

C15H22O3_Naphtho[1,2-b]furan-2(3H)-one, 3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-3,5a,9-trimethyl

NCGC00169016-02_C15H22O3_Naphtho[1,2-b]furan-2(3H)-one, 3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-3,5a,9-trimethyl-

C15H22O3 (250.1568862)


   

C15H22O3_3,8a-Dihydroxy-5-isopropylidene-3,8-dimethyl-2,3,3a,4,5,8a-hexahydro-6(1H)-azulenone

NCGC00385849-01_C15H22O3_3,8a-Dihydroxy-5-isopropylidene-3,8-dimethyl-2,3,3a,4,5,8a-hexahydro-6(1H)-azulenone

C15H22O3 (250.1568862)


   

(3aR,4aS,5S,5aR,6aR)-5-(3-hydroxybutyl)-5a-methyl-3-methylidene-3a,4,4a,5,6,6a-hexahydrocyclopropa[f][1]benzofuran-2-one

(3aR,4aS,5S,5aR,6aR)-5-(3-hydroxybutyl)-5a-methyl-3-methylidene-3a,4,4a,5,6,6a-hexahydrocyclopropa[f][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

6,7-bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one

6,7-bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one

C15H22O3 (250.1568862)


   

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,⁶]undec-2-en-9-one

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,⁶]undec-2-en-9-one

C15H22O3 (250.1568862)


   

2-(4-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid

2-(4-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid

C15H22O3 (250.1568862)


   

Ditrimethylolpropane

2,2-(Oxydimethanediyl)bis(2-ethylpropane-1,3-diol)

C12H26O5 (250.17801459999998)


CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3386; ORIGINAL_PRECURSOR_SCAN_NO 3383 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3354; ORIGINAL_PRECURSOR_SCAN_NO 3351 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3381; ORIGINAL_PRECURSOR_SCAN_NO 3380 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3363; ORIGINAL_PRECURSOR_SCAN_NO 3361 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3431; ORIGINAL_PRECURSOR_SCAN_NO 3427 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3382; ORIGINAL_PRECURSOR_SCAN_NO 3380 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7019; ORIGINAL_PRECURSOR_SCAN_NO 7016 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7038; ORIGINAL_PRECURSOR_SCAN_NO 7036 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7056; ORIGINAL_PRECURSOR_SCAN_NO 7054 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7076; ORIGINAL_PRECURSOR_SCAN_NO 7074 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7066; ORIGINAL_PRECURSOR_SCAN_NO 7063 CONFIDENCE standard compound; INTERNAL_ID 439; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7091; ORIGINAL_PRECURSOR_SCAN_NO 7088

   

Octylparaben

Octyl 4-hydroxybenzoate

C15H22O3 (250.1568862)


CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5002; ORIGINAL_PRECURSOR_SCAN_NO 5000 CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5677; ORIGINAL_PRECURSOR_SCAN_NO 5676 CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5711; ORIGINAL_PRECURSOR_SCAN_NO 5709 CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5044; ORIGINAL_PRECURSOR_SCAN_NO 5041 CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5060; ORIGINAL_PRECURSOR_SCAN_NO 5057 CONFIDENCE standard compound; INTERNAL_ID 1060; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5067; ORIGINAL_PRECURSOR_SCAN_NO 5062

   

3-Hydroxylidocaine; LC-tDDA; CE10

3-Hydroxylidocaine; LC-tDDA; CE10

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; LC-tDDA; CE20

3-Hydroxylidocaine; LC-tDDA; CE20

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; LC-tDDA; CE30

3-Hydroxylidocaine; LC-tDDA; CE30

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; LC-tDDA; CE40

3-Hydroxylidocaine; LC-tDDA; CE40

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE0; CorrDec

3-Hydroxylidocaine; AIF; CE0; CorrDec

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE10; CorrDec

3-Hydroxylidocaine; AIF; CE10; CorrDec

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE30; CorrDec

3-Hydroxylidocaine; AIF; CE30; CorrDec

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE0; MS2Dec

3-Hydroxylidocaine; AIF; CE0; MS2Dec

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE10; MS2Dec

3-Hydroxylidocaine; AIF; CE10; MS2Dec

C14H22N2O2 (250.1681192)


   

3-Hydroxylidocaine; AIF; CE30; MS2Dec

3-Hydroxylidocaine; AIF; CE30; MS2Dec

C14H22N2O2 (250.1681192)


   

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,⁶]undec-2-en-9-one_major

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,⁶]undec-2-en-9-one_major

C15H22O3 (250.1568862)


   

(4aR,5S,8aS,9aR)-9a-hydroxy-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-2-one_major

(4aR,5S,8aS,9aR)-9a-hydroxy-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-2-one_major

C15H22O3 (250.1568862)


   

2-[(1S,2S,4aR,8aS)-1-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid_major

2-[(1S,2S,4aR,8aS)-1-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid_major

C15H22O3 (250.1568862)


   

Hydroxyvalerenic Acid_major

Hydroxyvalerenic Acid_major

C15H22O3 (250.1568862)


   

6-hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one_major

6-hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one_major

C15H22O3 (250.1568862)


   

Hydroxyvalerenic Acid_67.1\\%

Hydroxyvalerenic Acid_67.1\\%

C15H22O3 (250.1568862)


   

2-[(2S,4aR,8aS)-2-hydroxy-4a-methyl-8-methylidene-3,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid_major

2-[(2S,4aR,8aS)-2-hydroxy-4a-methyl-8-methylidene-3,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid_major

C15H22O3 (250.1568862)


   

2-[(1S,2S,4aR,8aS)-1-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid_minor

2-[(1S,2S,4aR,8aS)-1-hydroxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid_minor

C15H22O3 (250.1568862)


   

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,?]undec-2-en-9-one

8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0²,?]undec-2-en-9-one

C15H22O3 (250.1568862)


   

Gemfibrozil, metabolite II

Gemfibrozil, metabolite II

C15H22O3 (250.1568862)


   
   

(+)-Armillarin

(+)-5beta,6alpha-dihydroxy-7-protoilluden-14-al

C15H22O3 (250.1568862)


   

1-Hydroxyacorenone

1-hydroxy-4,8-dimethyl-1-(propan-2-yl)spiro[4.5]dec-8-ene-2,7-dione

C15H22O3 (250.1568862)


   

Blennin A

4-hydroxy-6,6,8-trimethyl-1H,3H,3aH,4H,4aH,5H,6H,7H,7aH,8H-azuleno[5,6-c]furan-1-one

C15H22O3 (250.1568862)


   

PROCURCUMADIOL

3,3a-dihydroxy-3,8-dimethyl-5-(propan-2-ylidene)-1,2,3,3a,4,5,6,8a-octahydroazulen-6-one

C15H22O3 (250.1568862)


   

Furanofukinol

3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4,6-diol

C15H22O3 (250.1568862)


   

Heliannuol D

2-(2-hydroxypropan-2-yl)-5,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol

C15H22O3 (250.1568862)


   

6beta-Hydroxyeremphilenolide

4-hydroxy-3,4a,5-trimethyl-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

C15H22O3 (250.1568862)


   

Ketosantalic acid

5-{2,3-dimethyltricyclo[2.2.1.0^{2,6}]heptan-3-yl}-2-methyl-4-oxopentanoic acid

C15H22O3 (250.1568862)


   

Isotrichodermol

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-10-ol

C15H22O3 (250.1568862)


A trichothecene mycotoxin produced by Fusarium graminearum. It is a biosynthetic precursor in the synthesis of T2-toxin.

   

3b-Hydroxymarasmene

5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0^{1,6}.0^{12,15}]pentadec-8-en-4-ol

C15H22O3 (250.1568862)


   

13-Hydroxymarasmene

{5-methyl-11,13-dioxatetracyclo[7.5.1.0^{1,6}.0^{12,15}]pentadec-8-en-5-yl}methanol

C15H22O3 (250.1568862)


   

3-Ketoapotrichothecene

6-(hydroxymethyl)-1,2,10-trimethyl-7-oxatricyclo[6.4.0.0^{2,6}]dodec-9-en-4-one

C15H22O3 (250.1568862)


   

Valerenolic acid

(2E)-3-(1-hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid

C15H22O3 (250.1568862)


   

Oxopelenolide a

3,6,10-trimethyl-2H,3H,3aH,4H,5H,8H,9H,10H,11H,11aH-cyclodeca[b]furan-2,9-dione

C15H22O3 (250.1568862)


   

FS4 toxin

4-(4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl)-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

C15H22O3 (250.1568862)


   

Blennin C

3-[2-(4,4-dimethylcyclopent-1-en-1-yl)propyl]-4-(hydroxymethyl)-2,5-dihydrofuran-2-one

C15H22O3 (250.1568862)


   

3b-Hydroxycinnamolide

7-hydroxy-6,6,9a-trimethyl-1H,3H,5H,5aH,6H,7H,8H,9H,9aH,9bH-naphtho[1,2-c]furan-3-one

C15H22O3 (250.1568862)


   

Heliannuol A

2,2,6,9-tetramethyl-3,4,5,6-tetrahydro-2H-1-benzoxocine-3,8-diol

C15H22O3 (250.1568862)


   

(3beta,8beta)-3-Hydroxy-7(11)-eremophilen-12,8-olide

6-hydroxy-3,4a,5-trimethyl-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

C15H22O3 (250.1568862)


   

6-Hydroxy-3,5a,9-trimethyl-3a,4,5,5a,6,7,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one

6-Hydroxy-3,5a,9-trimethyl-3a,4,5,5a,6,7,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one

C15H22O3 (250.1568862)


   

2-(4-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl)acrylic acid

2-(4-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl)acrylic acid

C15H22O3 (250.1568862)


   

(1aS,2R,6R,7R,7aR,7bR)-1a-Isopropenyl-7,7a-dimethyl-1a,2,4,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxirene-2,6-diol

(1aS,2R,6R,7R,7aR,7bR)-1a-Isopropenyl-7,7a-dimethyl-1a,2,4,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxirene-2,6-diol

C15H22O3 (250.1568862)


   

3,7-Dihydroxy-9,11-eremophiladien-8-one

(3S,4aR,5R,6R)-3,6-Dihydroxy-3-isopropenyl-4a,5-dimethyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone

C15H22O3 (250.1568862)


   

Dihydroterrecyclic acid

(3R,3aR,4R,7R)-3,8,8-trimethyl-2-oxooctahydro-3a,7-ethanoindene-4-carboxylic acid

C15H22O3 (250.1568862)


   

Quadrangolin A

2-[(1S,2S,4aR,8aS)-1-Hydroxy-4a-methyl-8-methylenedecahydro-2-naphthalenyl]acrylic acid

C15H22O3 (250.1568862)


   

7-hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-2,4,5,7,8,8a-hexahydro-4,7-methanoazulen-6(1H)-one

7-hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-2,4,5,7,8,8a-hexahydro-4,7-methanoazulen-6(1H)-one

C15H22O3 (250.1568862)


   

Mumiamicin

5-(3-heptanyl)-3-methyl-furan-2-yl-prope-2E-noic acid

C15H22O3 (250.1568862)


   

MG O-12:5

1-O-(1E,3E,5E,7E,9E-dodecapentenyl)-sn-glycerol

C15H22O3 (250.1568862)


   

Ngaione (-)

(2S,5R)-4-methyl-l-(5-methyl-2,3,4,5-tetrahydro[2 ,3 -bifuran]-5-yl)pentan-2-one

C15H22O3 (250.1568862)


   

dihydrosporogen-AO-1

(3R,4R,4aR,6R)-4,4a-dimethyl-5,6-epoxy-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene-3,8-diol-1alpha,3alpha,4betaH-eremophila-9,11-diene-1,3-diol

C15H22O3 (250.1568862)


   
   

1-deoxy-11beta-hydroxypentalenic acid

1-deoxy-11beta-hydroxypentalenic acid

C15H22O3 (250.1568862)


A tricyclic sesquiterpenoid that is pentalenene in which the 13-methyl group is oxidsed to the carboxylic acid and a hydroxy substituent is located at position 11.

   

RIVASTIGMINE

RIVASTIGMINE

C14H22N2O2 (250.1681192)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors N - Nervous system > N06 - Psychoanaleptics > N06D - Anti-dementia drugs > N06DA - Anticholinesterases D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D020011 - Protective Agents D004791 - Enzyme Inhibitors

   

4-(3-Boc-aminopropyl)aniline

4-(3-Boc-aminopropyl)aniline

C14H22N2O2 (250.1681192)


   

2-(4-ETHOXY-PHENYL)-2-MORPHOLIN-4-YL-ETHYLAMINE

2-(4-ETHOXY-PHENYL)-2-MORPHOLIN-4-YL-ETHYLAMINE

C14H22N2O2 (250.1681192)


   

4-boc-aminomethylphenethylamine

4-boc-aminomethylphenethylamine

C14H22N2O2 (250.1681192)


   
   

5-BROMO 2-ISOBUTOXY BENZONITIRLE

5-BROMO 2-ISOBUTOXY BENZONITIRLE

C15H22O3 (250.1568862)


   

tert-Butyl 3-(aminomethyl)benzyl(methyl)carbamate

tert-Butyl 3-(aminomethyl)benzyl(methyl)carbamate

C14H22N2O2 (250.1681192)


   

4-methoxy-3-(2-piperidin-1-ylethoxy)aniline

4-methoxy-3-(2-piperidin-1-ylethoxy)aniline

C14H22N2O2 (250.1681192)


   

2-Ethylhexyl salicylate

2-Ethylhexyl salicylate

C15H22O3 (250.1568862)


D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates D020011 - Protective Agents > D011837 - Radiation-Protective Agents > D013473 - Sunscreening Agents C1892 - Chemopreventive Agent > C851 - Sunscreen D003879 - Dermatologic Agents D003358 - Cosmetics

   

2-(OCTYLOXY)BENZOIC ACID

2-(OCTYLOXY)BENZOIC ACID

C15H22O3 (250.1568862)


   

tert-Butyl (2-(benzylamino)ethyl)carbamate

tert-Butyl (2-(benzylamino)ethyl)carbamate

C14H22N2O2 (250.1681192)


   

3,5-Bis-tert-butylsalicylic acid

3,5-Bis-tert-butylsalicylic acid

C15H22O3 (250.1568862)


   

1-(2-AMINO-4-METHOXY-3-METHYLPHENYL)ETHANONE

1-(2-AMINO-4-METHOXY-3-METHYLPHENYL)ETHANONE

C14H22N2O2 (250.1681192)


   

1-BENZYLOXY-3-PIPERAZIN-1-YL-PROPAN-2-OL

1-BENZYLOXY-3-PIPERAZIN-1-YL-PROPAN-2-OL

C14H22N2O2 (250.1681192)


   

N-butan-2-yl-3-methyl-4-nitro-N-propylaniline

N-butan-2-yl-3-methyl-4-nitro-N-propylaniline

C14H22N2O2 (250.1681192)


   

tert-butyl N-[2-amino-2-(2-methylphenyl)ethyl]carbamate

tert-butyl N-[2-amino-2-(2-methylphenyl)ethyl]carbamate

C14H22N2O2 (250.1681192)


   

p-Octyloxybenzoic Acid

p-Octyloxybenzoic Acid

C15H22O3 (250.1568862)


   

Biphenyl, 4-(4-methylcyclohexyl)-, trans-

Biphenyl, 4-(4-methylcyclohexyl)-, trans-

C19H22 (250.1721412)


   

Biphenyl, 4-(4-methylcyclohexyl)-, cis

Biphenyl, 4-(4-methylcyclohexyl)-, cis

C19H22 (250.1721412)


   

4,4-(DIMETHYLCYCLOHEX-2-ENONE)-2-BORONIC ACID, PINACOL ESTER

4,4-(DIMETHYLCYCLOHEX-2-ENONE)-2-BORONIC ACID, PINACOL ESTER

C14H23BO3 (250.1740158)


   

N-METHYL-N-[3-(2-MORPHOLIN-4-YLETHOXY)BENZYL]AMINE

N-METHYL-N-[3-(2-MORPHOLIN-4-YLETHOXY)BENZYL]AMINE

C14H22N2O2 (250.1681192)


   

2-[2-(BENZYLOXY)ETHYL]-5,5-DIMETHYL-1,3-DIOXANE

2-[2-(BENZYLOXY)ETHYL]-5,5-DIMETHYL-1,3-DIOXANE

C15H22O3 (250.1568862)


   
   
   

1,3-adamantanediacetamide

1,3-adamantanediacetamide

C14H22N2O2 (250.1681192)


   

1,6-HEXAMETHYLENE-BIS-CYANOGUANIDINE

1,6-HEXAMETHYLENE-BIS-CYANOGUANIDINE

C10H18N8 (250.1654348)


   

2-[4-(2-AMINO-ETHYL)-PHENOXY]-N,N-DIETHYL-ACETAMIDE

2-[4-(2-AMINO-ETHYL)-PHENOXY]-N,N-DIETHYL-ACETAMIDE

C14H22N2O2 (250.1681192)


   

n-(6-aminohexyl)aminomethyltrimethoxysilane

n-(6-aminohexyl)aminomethyltrimethoxysilane

C10H26N2O3Si (250.17126059999998)


   

1,3-diacetamidoadamantane

1,3-diacetamidoadamantane

C14H22N2O2 (250.1681192)


   

1-(3,5-Dimethoxyphenyl)heptan-1-one

1-(3,5-Dimethoxyphenyl)heptan-1-one

C15H22O3 (250.1568862)


   

(R)-TERT-BUTYL (2-AMINO-3-PHENYLPROPYL)CARBAMATE

(R)-TERT-BUTYL (2-AMINO-3-PHENYLPROPYL)CARBAMATE

C14H22N2O2 (250.1681192)


   
   
   

tert-Butyl (2-aminoethyl)(benzyl)carbamate

tert-Butyl (2-aminoethyl)(benzyl)carbamate

C14H22N2O2 (250.1681192)


   

tetraetylene glycol monobutyl ether

tetraetylene glycol monobutyl ether

C12H26O5 (250.17801459999998)


   

1-PIPERAZIN-1-YL-3-M-TOLYLOXY-PROPAN-2-OL

1-PIPERAZIN-1-YL-3-M-TOLYLOXY-PROPAN-2-OL

C14H22N2O2 (250.1681192)


   

tert-butyl 2-cyano-7-azaspiro[3.5]nonane-7-carboxylate

tert-butyl 2-cyano-7-azaspiro[3.5]nonane-7-carboxylate

C14H22N2O2 (250.1681192)


   

tert-butyl (1-amino-3-phenylpropan-2-yl)carbamate

tert-butyl (1-amino-3-phenylpropan-2-yl)carbamate

C14H22N2O2 (250.1681192)


   

2-(2,2-Diethoxyethoxy)-1,1-diethoxyethane

2-(2,2-Diethoxyethoxy)-1,1-diethoxyethane

C12H26O5 (250.17801459999998)


   

propyl [3-(1,1-dimethylethyl)phenoxy]acetate

propyl [3-(1,1-dimethylethyl)phenoxy]acetate

C15H22O3 (250.1568862)


   
   

tert-butyl 3-(2-phenylethoxy)propanoate

tert-butyl 3-(2-phenylethoxy)propanoate

C15H22O3 (250.1568862)


   
   

2-AMINO-4-(4-METHOXY-PHENYL)THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER

2-AMINO-4-(4-METHOXY-PHENYL)THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER

C15H22O3 (250.1568862)


   

5,5-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-2-en-1-one

5,5-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-2-en-1-one

C14H23BO3 (250.1740158)


   
   

TERT-BUTYL 2-(AMINOMETHYL)-4-METHYLBENZYLCARBAMATE

TERT-BUTYL 2-(AMINOMETHYL)-4-METHYLBENZYLCARBAMATE

C14H22N2O2 (250.1681192)


   

(1S,4aS,8aS)-1-Hydroxy-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphtha lene-1,2-dicarbaldehyde

(1S,4aS,8aS)-1-Hydroxy-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphtha lene-1,2-dicarbaldehyde

C15H22O3 (250.1568862)


   

2-octyloxyphenylboronicacid

2-octyloxyphenylboronicacid

C14H23BO3 (250.1740158)


   

2, 4-dibutoxy benzaldehyde

2, 4-dibutoxy benzaldehyde

C15H22O3 (250.1568862)


   

4-{[(3-Dimethylamino-propyl)-methyl-amino]-methyl}-benzoic acid

4-{[(3-Dimethylamino-propyl)-methyl-amino]-methyl}-benzoic acid

C14H22N2O2 (250.1681192)


   

2-Methyl-2-propanyl (3-amino-1-phenylpropyl)carbamate

2-Methyl-2-propanyl (3-amino-1-phenylpropyl)carbamate

C14H22N2O2 (250.1681192)


   

O-Ethylhydroxylamine hydrochloride

O-Ethylhydroxylamine hydrochloride

C15H22O3 (250.1568862)


   

3-[4-(2-Methoxyphenyl)-1-piperazinyl]-1-propanol

3-[4-(2-Methoxyphenyl)-1-piperazinyl]-1-propanol

C14H22N2O2 (250.1681192)


   

[4-(Octyloxy)phenyl]boronic acid

[4-(Octyloxy)phenyl]boronic acid

C14H23BO3 (250.1740158)


   

Methyl 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propionate

Methyl 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propionate

C15H22O3 (250.1568862)


   

2-Naphthaleneacetic acid, decahydro-1-hydroxy-4a-methyl-alpha,8-bis(methylene)-, [1S-(1alpha,2beta,4abeta,8aalpha)]-

2-Naphthaleneacetic acid, decahydro-1-hydroxy-4a-methyl-alpha,8-bis(methylene)-, [1S-(1alpha,2beta,4abeta,8aalpha)]-

C15H22O3 (250.1568862)


   

(3R)-4alpha,4aalpha-Dimethyl-3beta,6beta-dihydroxy-1,2,3,4,4a,5,6,7-octahydro-6alpha-isopropenylnaphthalen-7-one

(3R)-4alpha,4aalpha-Dimethyl-3beta,6beta-dihydroxy-1,2,3,4,4a,5,6,7-octahydro-6alpha-isopropenylnaphthalen-7-one

C15H22O3 (250.1568862)


   

2-(Diethylamino)-N-(4-hydroxy-2,6-dimethylphenyl)acetamide

2-(Diethylamino)-N-(4-hydroxy-2,6-dimethylphenyl)acetamide

C14H22N2O2 (250.1681192)


   
   

8-Hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.02,6]undec-2-en-9-one

8-Hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.02,6]undec-2-en-9-one

C15H22O3 (250.1568862)


   

3a-hydroxy-3,5a,9-trimethyl-4,5,6,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2-one

3a-hydroxy-3,5a,9-trimethyl-4,5,6,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

6-(3-hydroxybutyl)-7-methyl-3-methylidene-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

6-(3-hydroxybutyl)-7-methyl-3-methylidene-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-2-one

C15H22O3 (250.1568862)


   
   

(1R,4S,5E,8R,9R)-4-hydroxy-5-methyl-8-(prop-1-en-2-yl)-10-oxabicyclo[7.2.1]dodec-5-en-11-one

(1R,4S,5E,8R,9R)-4-hydroxy-5-methyl-8-(prop-1-en-2-yl)-10-oxabicyclo[7.2.1]dodec-5-en-11-one

C15H22O3 (250.1568862)


   

5-[(1S)-2,6,6-Trimethyl-4-oxo-1-hydroxy-2-cyclohexenyl]-3-methyl-2,4-pentadien-1-ol

5-[(1S)-2,6,6-Trimethyl-4-oxo-1-hydroxy-2-cyclohexenyl]-3-methyl-2,4-pentadien-1-ol

C15H22O3 (250.1568862)


   

2-trans,4-trans-Xanthoxin

2-trans,4-trans-Xanthoxin

C15H22O3 (250.1568862)


An apo carotenoid sesquiterpenoid that is xanthoxin in which the double bonds at positions 2 and 4 have E (trans) configuration. D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids

   

4-Desoxyabscisic acid

4-Desoxyabscisic acid

C15H22O3 (250.1568862)


   
   

12,13-Epoxy-trichothec-9-en-4beta-ol

12,13-Epoxy-trichothec-9-en-4beta-ol

C15H22O3 (250.1568862)


   

(5R,7S)-5,7-dihydroxy-2,2,5,7-tetramethylspiro[1,3-dihydroindene-6,1-cyclopropane]-4-one

(5R,7S)-5,7-dihydroxy-2,2,5,7-tetramethylspiro[1,3-dihydroindene-6,1-cyclopropane]-4-one

C15H22O3 (250.1568862)


   

2-Methylpropyl 2-benzyl-3-hydroxybutanoate

2-Methylpropyl 2-benzyl-3-hydroxybutanoate

C15H22O3 (250.1568862)


   

(2Z,4E)-5-[(1R,4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

(2Z,4E)-5-[(1R,4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

C15H22O3 (250.1568862)


   

(2Z,4E)-5-[(1R,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

(2Z,4E)-5-[(1R,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

C15H22O3 (250.1568862)


   

(4R)-4-(5,5-dimethylcyclohexen-1-yl)-4-hydroxycyclohexene-1-carboxylic acid

(4R)-4-(5,5-dimethylcyclohexen-1-yl)-4-hydroxycyclohexene-1-carboxylic acid

C15H22O3 (250.1568862)


   

(4S)-4-[(6S)-6-hydroxy-5,5-dimethylcyclohexen-1-yl]cyclohexene-1-carboxylic acid

(4S)-4-[(6S)-6-hydroxy-5,5-dimethylcyclohexen-1-yl]cyclohexene-1-carboxylic acid

C15H22O3 (250.1568862)


   

(1S,2R,5R,9R)-9-hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

(1S,2R,5R,9R)-9-hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

C15H22O3 (250.1568862)


   

Eunicea sesquiterpenoid 3

Eunicea sesquiterpenoid 3

C15H22O3 (250.1568862)


A natural product found in Eunicea.

   

4,6-Diene-1beta,14-dihydroxyeudesma-3-one

4,6-Diene-1beta,14-dihydroxyeudesma-3-one

C15H22O3 (250.1568862)


A natural product found in Aglaia foveolata.

   

Eunicea sesquiterpenoid 2

Eunicea sesquiterpenoid 2

C15H22O3 (250.1568862)


A eudesmane sesquiterpenoid in which the eudesmane skeleton is substituted with an alpha-hydroxy group at C-1 (eudesmane numbering) and a methylidene group at C-4, and includes a lactone ring formed between C-12 and a beta-hydroxy group at C-6. It is isolated from Eunicea sp. and exhibits significant inhibitory effect upon the growth of the malarial parasite Plasmodium falciparum

   

(+)-Dioxosarcoguaiacol, (rel)-

(+)-Dioxosarcoguaiacol, (rel)-

C15H22O3 (250.1568862)


A natural product found in Acorus calamus and Sarcophyton glaucum.

   

3beta-Hydroxycinnamolide

3beta-Hydroxycinnamolide

C15H22O3 (250.1568862)


   

14-Hydroxy-6,12-muuroloadien-15-oic acid

14-Hydroxy-6,12-muuroloadien-15-oic acid

C15H22O3 (250.1568862)


A sesquiterpenoid isolated from the leaves of Eremophila mitchellii.

   

Samboginone, (rel)-

Samboginone, (rel)-

C15H22O3 (250.1568862)


A natural product found in Blumea balsamifera.

   

2-[(1S,5S)-5-methyl-4-(3-oxobutyl)cyclohept-3-en-1-yl]prop-2-enoic acid

2-[(1S,5S)-5-methyl-4-(3-oxobutyl)cyclohept-3-en-1-yl]prop-2-enoic acid

C15H22O3 (250.1568862)


   
   
   

5-Dehydro-6-demethoxyfumagillol

5-Dehydro-6-demethoxyfumagillol

C15H22O3 (250.1568862)


   

N-methyl-alpha-berbine

N-methyl-alpha-berbine

C18H20N+ (250.159566)


   

(2E)-2-[(3aR,4S,8aR)-4-hydroxy-3a,6-dimethyl-2,3,4,5,8,8a-hexahydroazulen-1-ylidene]propanoic acid

(2E)-2-[(3aR,4S,8aR)-4-hydroxy-3a,6-dimethyl-2,3,4,5,8,8a-hexahydroazulen-1-ylidene]propanoic acid

C15H22O3 (250.1568862)


   

(4-Hexylphenoxy)(trimethyl)silane

(4-Hexylphenoxy)(trimethyl)silane

C15H26OSi (250.1752826)


   

2-[2-(2-Ethoxyethoxy)ethoxy]ethoxy-trimethylsilane

2-[2-(2-Ethoxyethoxy)ethoxy]ethoxy-trimethylsilane

C11H26O4Si (250.16002759999998)


   

Silane, (alpha,alpha-dimethyl-p-isopropylbenzyloxy)trimethyl-

Silane, (alpha,alpha-dimethyl-p-isopropylbenzyloxy)trimethyl-

C15H26OSi (250.1752826)


   

4-Benzyloxy-3-methylvaleric acid ethyl ester

4-Benzyloxy-3-methylvaleric acid ethyl ester

C15H22O3 (250.1568862)


   

(2S,3S)-4-Benzyloxy-3-methylbutan-1,2-diolisopropylidene acetal

(2S,3S)-4-Benzyloxy-3-methylbutan-1,2-diolisopropylidene acetal

C15H22O3 (250.1568862)


   

1,6-Trimethylene-3,3-diethyl-4-oxobicyclo[3.1.0]hexane-5-carboxylic acid methyl ester

1,6-Trimethylene-3,3-diethyl-4-oxobicyclo[3.1.0]hexane-5-carboxylic acid methyl ester

C15H22O3 (250.1568862)


   
   
   

2-[(1S,2R,3E,7E)-2-Hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

2-[(1S,2R,3E,7E)-2-Hydroxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid

C15H22O3 (250.1568862)


   

(2S,3R,5R,8S)-3-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

(2S,3R,5R,8S)-3-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

C15H22O3 (250.1568862)


   

(2R,5R,8S,9R)-9-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

(2R,5R,8S,9R)-9-Hydroxy-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carboxylic acid

C15H22O3 (250.1568862)


   

Xanthoxin

2-cis,2-trans-Xanthoxin

C15H22O3 (250.1568862)


D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids

   

2-Ethylhexyl 4-Hydroxybenzoate

2-Ethylhexyl-4-hydroxybenzoate

C15H22O3 (250.1568862)


   
   

Naepaine

Naepaine

C14H22N2O2 (250.1681192)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

3beta-Dihydroxymarasmene

3beta-Dihydroxymarasmene

C15H22O3 (250.1568862)


   

(3beta,6beta)-Furanoeremophilane-3,6-diol

(3beta,6beta)-Furanoeremophilane-3,6-diol

C15H22O3 (250.1568862)


   

3,3a-Dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,4,8a-tetrahydroazulen-6-one

3,3a-Dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,4,8a-tetrahydroazulen-6-one

C15H22O3 (250.1568862)


   

(6beta,8alpha)-6-Hydroxy-7(11)-eremophilen-12,8-olide

(6beta,8alpha)-6-Hydroxy-7(11)-eremophilen-12,8-olide

C15H22O3 (250.1568862)


   

3a-(hydroxymethyl)-6,8a,8b-trimethyl-3,4a,7,8-tetrahydro-1H-cyclopenta[b][1]benzofuran-2-one

3a-(hydroxymethyl)-6,8a,8b-trimethyl-3,4a,7,8-tetrahydro-1H-cyclopenta[b][1]benzofuran-2-one

C15H22O3 (250.1568862)


   

Hydroxypentadecatetraenoic acid

Hydroxypentadecatetraenoic acid

C15H22O3 (250.1568862)


   

2-Desoxy-4-epi-pulchellin

2-Desoxy-4-epi-pulchellin

C15H22O3 (250.1568862)


2-Desoxy-4-epi-pulchellin (compound 13) is a compound isolated from dichloromethane-soluble portion of Polygonum hydropiper[1].