Exact Mass: 266.1646872

D020011 - Protective Agents > D011837 - Radiation-Protective Agents

Zinniol

Mukaadial

Rugosal

Rugosal A; Rugosal

Practolol

N-[4-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide

Practolol is only found in individuals that have used or taken this drug. It is a beta-adrenergic antagonist that has been used in the emergency treatment of cardiac arrhythmias. [PubChem]Like other beta-adrenergic antagonists, practolol competes with adrenergic neurotransmitters such as catecholamines for binding at sympathetic receptor sites. Like propranolol and timolol, practolol binds at beta(1)-adrenergic receptors in the heart and vascular smooth muscle, inhibiting the effects of the catecholamines epinephrine and norepinephrine and decreasing heart rate, cardiac output, and systolic and diastolic blood pressure. C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AB - Beta blocking agents, selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Same as: D05587 Practolol is a potent and selective β1-adrenergic receptor antagonist. Practolol can be used for the research of cardiac arrhythmias[1][2][3].

Xanthoxic acid

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

Xanthoxic acid, known scientifically as 3,4,5-trimethoxybenzoic acid, is an organic compound belonging to the class of aromatic acids. It is characterized by a benzene ring with hydroxyl groups (OH) substituted at the 3, 4, and 5 positions with methoxy groups (OCH₃). This chemical structure imparts specific chemical and biological properties to xanthoxic acid. Chemically, xanthoxic acid is a white to yellowish crystalline solid, which is soluble in organic solvents but less soluble in water. Its chemical formula is C10H12O5, and it has a molecular weight of approximately 212.21 g/mol. Biologically, xanthoxic acid exhibits a range of pharmacological activities. It has been noted for its anti-inflammatory, antibacterial, and antifungal properties. These activities are attributed to its ability to interfere with various cellular processes, including inflammation and microbial growth. In traditional medicine, particularly in Chinese medicine, plants containing xanthoxic acid are used to treat conditions such as gastrointestinal disorders, skin infections, and as a general health tonic. In terms of its natural occurrence, xanthoxic acid is found in several plants, notably in the roots, stems, and leaves of certain species. It is particularly abundant in plants like Phellodendron amurense (Amur cork tree) and Coptis chinensis (Chinese goldthread), which are used in traditional Chinese medicine. From a pharmacological perspective, xanthoxic acid and its derivatives are of interest for their potential in drug development. Researchers are exploring its anti-inflammatory and potential anticancer properties, aiming to develop new therapeutic agents that can effectively treat these conditions with fewer side effects. In summary, xanthoxic acid is a multifaceted compound with diverse biological activities and potential medicinal applications. Its presence in traditional medicinal plants and its pharmacological properties make it a subject of interest in both traditional and modern medicine.

6alpha,8beta-Dihydroxygermacra-1(10),4,11(13)-trien-12-oate

atenolol

(±)-2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acetamide

C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AB - Beta blocking agents, selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents CONFIDENCE standard compound; INTERNAL_ID 4076 CONFIDENCE Reference Standard (Level 1) CONFIDENCE standard compound; INTERNAL_ID 1106 Atenolol ((RS)-Atenolol) is a cardioselective β1-adrenergic receptor blocker, with a Ki of 697 nM at β1-adrenoceptor in guine pig left ventricle membrane. Atenolol can be used for the research of hypertension and angina pectoris[1][2].

Atenolol

(±)-2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acetamide

Atenolol is a so-called beta1-selective (or cardioselective) drug. That means that it exerts greater blocking activity on myocardial beta1-receptors than on beta2 ones in the lung. The beta2 receptors are responsible to keep the bronchial system open. If these receptors are blocked, bronchospasm with serious lack of oxygen in the body can result. However, due to its cardioselective properties, the risk of bronchospastic reactions if using atenolol is reduced compared to nonselective drugs as propranolol. Nonetheless, this reaction may also be encountered with atenolol, particularly with high doses. Extreme caution should be exerted if atenolol is given to asthma patients, who are particularly at risk; the dose should be as low as possible. If an asthma attack occurs, the inhalation of a beta2-mimetic antiasthmatic, such as hexoprenalin or salbutamol, will usually suppress the symptoms.; Atenolol (trade name Tenormin) can be used to treat cardiovascular diseases such as hypertension, coronary heart disease, arrhythmias, and treatment of myocardial infarction after the acute event. Patients with compensated congestive heart failure may be treated with atenolol as a co medication (usually together with an ACE inhibitor, a diuretic and a digitalis-glycoside, if indicated). In patients with congestive heart failure, it reduces the need for and the consumption of oxygen of the heart muscle. It is very important to start with low doses, as atenolol reduces also the muscular power of the heart, which is an undesired effect in congestive heart failure. [HMDB] Atenolol is a so-called beta1-selective (or cardioselective) drug. That means that it exerts greater blocking activity on myocardial beta1-receptors than on beta2 ones in the lung. The beta2 receptors are responsible to keep the bronchial system open. If these receptors are blocked, bronchospasm with serious lack of oxygen in the body can result. However, due to its cardioselective properties, the risk of bronchospastic reactions if using atenolol is reduced compared to nonselective drugs as propranolol. Nonetheless, this reaction may also be encountered with atenolol, particularly with high doses. Extreme caution should be exerted if atenolol is given to asthma patients, who are particularly at risk; the dose should be as low as possible. If an asthma attack occurs, the inhalation of a beta2-mimetic antiasthmatic, such as hexoprenalin or salbutamol, will usually suppress the symptoms. Atenolol (trade name Tenormin) can be used to treat cardiovascular diseases such as hypertension, coronary heart disease, arrhythmias, and treatment of myocardial infarction after the acute event. Patients with compensated congestive heart failure may be treated with atenolol as a co medication (usually together with an ACE inhibitor, a diuretic and a digitalis-glycoside, if indicated). In patients with congestive heart failure, it reduces the need for and the consumption of oxygen of the heart muscle. It is very important to start with low doses, as atenolol reduces also the muscular power of the heart, which is an undesired effect in congestive heart failure. C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AB - Beta blocking agents, selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Atenolol ((RS)-Atenolol) is a cardioselective β1-adrenergic receptor blocker, with a Ki of 697 nM at β1-adrenoceptor in guine pig left ventricle membrane. Atenolol can be used for the research of hypertension and angina pectoris[1][2].

Artemin

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

Artemin is found in herbs and spices. Artemin is a constituent of Artemisia species Constituent of Artemisia subspecies Artemin is found in herbs and spices.

Blennin D

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

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

Arlatin

6,6a-dihydroxy-3,6,9-trimethyl-2H,3H,3aH,4H,5H,6H,6aH,7H,9aH,9bH-azuleno[4,5-b]furan-2-one

Constituent of Artemisia absinthium (wormwood). Arlatin is found in alcoholic beverages and herbs and spices. Arlatin is found in alcoholic beverages. Arlatin is a constituent of Artemisia absinthium (wormwood)

10-Hydroxymyoporone

1-(furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione

10-Hydroxymyoporone is found in root vegetables. 10-Hydroxymyoporone is a stress metabolite of the sweet potato infected with Ceratocystis fimbriata. Stress metabolite of the sweet potato infected with Ceratocystis fimbriata. 10-Hydroxymyoporone is found in sweet potato and root vegetables.

(6beta,8betaOH)-6,8-Dihydroxy-7(11)-eremophilen-12,8-olide

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

(6beta,8aOH)-6,8-Dihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables. (6beta,8aOH)-6,8-Dihydroxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 6b,8a-Dihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables.

Arabsin

[3R-(3alpha,3abeta,5aalpha,6alpha,9beta,9abeta,9balpha)]-Octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione

Constituent of Artemisia absinthium (wormwood). Arabsin is found in alcoholic beverages and herbs and spices. Arabsin is found in alcoholic beverages. Arabsin is a constituent of Artemisia absinthium (wormwood)

Alkhanol

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

Alkhanol is found in herbs and spices. Alkhanol is a constituent of Balsamita major (costmary) Constituent of Balsamita major (costmary). Alkhanol is found in tea and herbs and spices.

Ipomeamaronolide

2,3,4,5-Tetrahydro-5-methyl-5-(4-methyl-2-oxopentyl)-[2,3-bifuran]-2(5H)-one, 9CI

Ipomeamaronolide is found in potato. Ipomeamaronolide is isolated from Ipomoea batatas (sweet potato) infected with Ceratocystis fimbriata. Isolated from Ipomoea batatas (sweet potato) infected with Ceratocystis fimbriata. Ipomeamaronolide is found in root vegetables and potato.

Humulinic acid A

3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)-2-(3-methylbutanoyl)cyclopent-2-en-1-one

Humulinic acid B is found in alcoholic beverages. Humulinic acid B is a constituent of hops Constituent of hops. Humulinic acid A is found in alcoholic beverages.

Sporol

[3S-(3alpha,4abeta,5aalpha,7b,8aalpha,8balpha)]-Hexahydro-3,8a-dimethyl-4a,7-Epoxy-3,8b-ethano-1H,5aH-cyclopenta[4,5]furo[3,2-c]pyran-5a-methanol

Sporol is a mycotoxin from Fusarium sporotrichioides MC-72083. Mycotoxin from Fusarium sporotrichioides MC-72083

3,14-Dihydroxy-11,13-dihydrocostunolide

9-hydroxy-6-(hydroxymethyl)-3,10-dimethyl-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-2-one

3,14-Dihydroxy-11,13-dihydrocostunolide is found in green vegetables. 3,14-Dihydroxy-11,13-dihydrocostunolide is a constituent of Lactuca sativa (lettuce) Constituent of Lactuca sativa (lettuce). 3,14-Dihydroxy-11,13-dihydrocostunolide is found in green vegetables.

(R)-Athanagrandione

1-(furan-3-yl)-4-hydroxy-4,8-dimethylnonane-1,6-dione

(R)-Athanagrandione is found in potato. (R)-Athanagrandione is producedby sweet potato tubers (Ipomoea batatas) infected by Fusarium solani. Productionby sweet potato tubers (Ipomoea batatas) infected by Fusarium solani. (R)-Athanagrandione is found in potato.

1alpha-Hydroxyarbusculin A

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

1alpha-Hydroxyarbusculin A is found in herbs and spices. 1alpha-Hydroxyarbusculin A is isolated from Tanacetum vulgare (tansy). Isolated from Tanacetum vulgare (tansy). 1alpha-Hydroxyarbusculin A is found in herbs and spices.

1alpha,15-Dihydroxymarasmene

4-Hydroxy-a-[3-hydroxy-5-oxo-4-(3,4,5-trihydroxyphenyl)-2(5H)-furanylidene]benzeneacetic acid, 9ci

1alpha,15-Dihydroxymarasmene is found in mushrooms. 1alpha,15-Dihydroxymarasmene is a metabolite of Marasmius oreades (fairy ring mushroom

Ipomeamaronol

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

Ipomeamaronol is found in potato. Ipomeamaronol is a constituent of sweet potato tubers infected with Ceratocystis fimbriata. Constituent of sweet potato tubers infected with Ceratocystis fimbriata. Ipomeamaronol is found in potato.

7-Hydroxytrichodermol

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-ene-3,11-diol

7-Hydroxytrichodermol is a mycotoxin from Myrothecium roridum. Flavouring ingredient

4'-Dihydroabscisic acid

(2E,4E)-5-(1,4-dihydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid

4-Dihydroabscisic acid is found in pulses. 4-Dihydroabscisic acid is isolated from immature seeds of broad bean (Vicia faba). Isolated from immature seeds of broad bean (Vicia faba). 4-Dihydroabscisic acid is found in pulses.

Absindiol

4,8-dihydroxy-3,6-dimethyl-9-methylidene-dodecahydroazuleno[4,5-b]furan-2-one

Constituent of Artemisia absinthium (wormwood). Absindiol is found in alcoholic beverages and herbs and spices. Absindiol is found in alcoholic beverages. Absindiol is a constituent of Artemisia absinthium (wormwood).

(3xi,6E)-1,7-Diphenyl-6-hepten-3-ol

trans－1,7－Diphenyl－5-hydroxy-1－hepten

(3xi,6E)-1,7-Diphenyl-6-hepten-3-ol is found in beverages. (3xi,6E)-1,7-Diphenyl-6-hepten-3-ol is a constituent of seeds of Curcuma xanthorrhiza (Java turmeric)

3alpha,15-Dihydroxymarasmene

5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0¹,⁶.0¹²,¹⁵]pentadec-8-ene-4,14-diol

3alpha,15-Dihydroxymarasmene is found in mushrooms. 3alpha,15-Dihydroxymarasmene is a metabolite of Marasmius oreades (fairy ring mushroom Metabolite of Marasmius oreades (fairy ring mushroom). 3alpha,15-Dihydroxymarasmene is found in mushrooms.

(1alpha,4alpha,5beta,6alpha,11betaH)-1,4-Epoxy-5-hydroxy-10(14)-germacren-12,6-olide

2-hydroxy-1,6-dimethyl-10-methylidene-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradecan-5-one

(1alpha,4alpha,5beta,6alpha,11betaH)-1,4-Epoxy-5-hydroxy-10(14)-germacren-12,6-olide is found in herbs and spices. (1alpha,4alpha,5beta,6alpha,11betaH)-1,4-Epoxy-5-hydroxy-10(14)-germacren-12,6-olide is a constituent of Achillea millefolium (yarrow). Constituent of Achillea millefolium (yarrow). (1alpha,4alpha,5beta,6alpha,11betaH)-1,4-Epoxy-5-hydroxy-10(14)-germacren-12,6-olide is found in herbs and spices.

Isoleptospermone

2,2,4,4-Tetramethyl-6-(2-methyl-1-oxobutyl)-1,3,5-cyclohexanetrione

Isoleptospermone is found in tea. Isoleptospermone is a constituent of Leptospermum scoparium (red tea) Constituent of Leptospermum scoparium (red tea). Isoleptospermone is found in tea.

Adhumulinic acid

4-hydroxy-5-(3-methylbut-2-en-1-yl)-2-(2-methylbutanoyl)cyclopentane-1,3-dione

Adhumulinic acid is found in alcoholic beverages. Adhumulinic acid is a constituent of hops Constituent of hops. Adhumulinic acid is found in alcoholic beverages.

Deoxyartemsinin

(1R,4R,5S,8R,9S,12S)-12-hydroxy-4,8,12-trimethyl-2,13-dioxatricyclo[7.4.1.0⁵,¹⁴]tetradec-6-en-3-one

Deoxyartemsinin is a metabolite of artemisinin. Artemisinin, also known as Qinghaosu, and its derivatives are a group of drugs that possess the most rapid action of all current drugs against Plasmodium falciparum malaria. Treatments containing an artemisinin derivative (artemisinin-combination therapies, ACTs) are now standard treatment worldwide for P. falciparum malaria. The starting compound artemisinin is isolated from the plant Artemisia annua, sweet wormwood, an herb employed in Chinese traditional medicine. (Wikipedia)

Bucolome

5-butyl-3-cyclohexyl-6-hydroxy-2,3,4,5-tetrahydropyrimidine-2,4-dione

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

Deoxyqinghaosu

1,5,9-trimethyl-11,14,15-trioxatetracyclo[10.2.1.0⁴,¹³.0⁸,¹³]pentadecan-10-one

D009676 - Noxae > D016877 - Oxidants > D010545 - Peroxides

CC(=O)Nccccccn1C=CC(=O)C(O)=C1C

N-[6-(3-Hydroxy-2-methyl-4-oxo-1,4-dihydropyridin-1-yl)hexyl]ethanimidate

Dilatan

Biopharma brand OF trimetazidine dihydrochloride

COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78274 - Agent Affecting Cardiovascular System > C78322 - Cardiotonic Agent D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents C - Cardiovascular system > C01 - Cardiac therapy Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

[4]-Gingerol

(5S)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octan-3-one

[4]-gingerol is a member of the class of compounds known as gingerols. Gingerols are compounds containing a gingerol moiety, which is structurally characterized by a 4-hydroxy-3-methoxyphenyl group substituted at the C6 carbon atom by a 5-hydroxy-alkane-3-one. [4]-gingerol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). [4]-gingerol can be found in ginger, which makes [4]-gingerol a potential biomarker for the consumption of this food product.

[4]-Isogingerol

6-hydroxy-8-(4-hydroxy-3-methoxyphenyl)octan-4-one

[4]-isogingerol 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. [4]-isogingerol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). [4]-isogingerol can be found in ginger, which makes [4]-isogingerol a potential biomarker for the consumption of this food product.

Potassium myristate

Potassium tetradecanoic acid

C14H27KO2 (266.1648022)

It is used as a food additive .

atenolol

(±)-2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acetamide

C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AB - Beta blocking agents, selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 169 Atenolol ((RS)-Atenolol) is a cardioselective β1-adrenergic receptor blocker, with a Ki of 697 nM at β1-adrenoceptor in guine pig left ventricle membrane. Atenolol can be used for the research of hypertension and angina pectoris[1][2].

Aspterric acid

(3R,4R,9aS)-4-hydroxy-7-(propan-2-ylidene)octahydro-1H-3,9a-methanocyclopenta[c]oxocine-4-carboxylic acid

Sambucinol

D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

Arsubin

[3R-(3alpha,3abeta,5aalpha,6alpha,9abeta,9balpha)]-Decahydro-6,9a-dihydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one

NSC634212

3a,4,4a,5,6,7,7a,8,9,9a-Decahydro-5,6-dihydroxy-4a,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one

Lejeuneapinguisanolide

Gallicadiol

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

9beta-Hydroxy-4beta,11beta,13,15-tetrahydrozaluzanin C

Kanshone D

Ambrosiol

Connatusin A

(-)-Pereniporin B

Alliacolide

Mairetolide F

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

Eriolin

Dihydroflorilenalin

Dihydroilludin S

Erivanin

[3S-(3alpha,3aalpha,5abeta,6alpha,8alpha,9aalpha,9bbeta)]-Decahydro-6,8-dihydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one

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

Hymenoratin G

Canusesnol F

11beta,13-Dihydro-epi-ligustrin

(11R)-11,13-Dihydrotatridin A

IVALBIN

Argentiolide A

[3S-(3R,3aR,5R,6E,10Z,11aS)]-3a,4,5,8,9,11a-Hexahydro-5-hydroxy-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one

[3S-(3R*,3aR*,5R*,6E,10Z,11aS*)]-3a,4,5,8,9,11a-Hexahydro-5-hydroxy-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one

11beta-Dihydroflabellin

(-)-11beta-Dihydroflabellin

Helibisabonol B

[3S-(3alpha,3aalpha,6beta,6aalpha,9aalpha,9bbeta)]-Decahydro-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylene-azuleno[4,5-b]furan-2(3H)-one

Ixerin K

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

6alpha,14-Dihydroxy-1(10)E,4E-germacradien-12,8alpha-olide

[3R-(3R*,3aS*,4R*,5E,9E,11aS*)]-3a,4,7,8,11,11a-Hexahydro-4-hydroxy-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one

Arsantin

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

SCHEMBL10307521

[3S-(3alpha,3aalpha,5abeta,6beta,7alpha,9aalpha,9bbeta)]-Decahydro-6,7-dihydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one

5-(1,4-Dihydroxy-2,2-dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadienoic acid

1alpha,3beta-Dihydroxy-4Z,9Z-germacradien-12,6alpha-olide

Dihydroridentin

1,3-Dihydroxy-4,10(14)-germacradien-12,6-olide

8alpha-Hydroxysambucoin

(+)-5(6)-Dihydro-6-hydroxyterrecyclic acid A

Rudmollin

9alpha-Hydroxydihydroparthenolide

Agglomerin A

Artapshin

[3S-(3alpha,3aalpha,4alpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-4,6-dihydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one

Pernetic acid D

2alpha-Hydroxydihydroparthenolide

1beta,10alpha-Dihydroxy-11(13)-eremophilen-12,8beta-olide

NSC113235

Cheimonophyllon A

Nardosinanol E

Hebelophyllene C

Eminensin B

Carolenalin

Castellanin

Cyperanic acid

Strobilol B

5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octan-3-one

(+)-Herbolide F

Desacylligulatin C

Shonachalin A

Grangolide

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

1beta,9beta-Dihydroxycostic acid

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

Versicolactone C

Massarinolin C

Dihydrovermeerin A

3beta-Hydroxy-11alpha,13-dihydroparthenolide

Gloeophyllol D

Heliannuol L

Iresin

Stereumin A

Franserin

(+)-Melitensin

10alpha,14-Epoxy-3beta-hydroxy-12,6alpha-guaianolide

3alpha-Hydroxy-1beta,10beta-epoxy-11betaH-eremophilan-12,8beta-olide

Furantriol

Kanshone B

Arbusculin D

[5aR-(5aalpha,9beta,9abeta,9balpha)]-5,5a,6,7,8,9,9a,9b-Octahydro-9-hydroxy-3-(hydroxymethyl)-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one

8beta,9beta-Dihydroxycostic acid

[2R-(2alpha,3alpha,4alpha,4aalpha,8abeta)]-Decahydro-3,4-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid

Isoiresin

Magnograndiolide

Dicorin

[3aR-(3aalpha,4aalpha,5alpha,8alpha,8abeta,9aalpha)]-Decahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one

Shonachalin B

Decahydro-3-hydroxy-3a,6,8c-trimethyloxireno[7,8]naphtho[1,2-b]furan-7(2H)-one

Clitocybulol C

Connatusin B

4alpha-Hydroxydihydroilludin M

[3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-Decahydro-3a-hydroperoxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one

Lingshuiolide B

Lactarorufin E

Fascicularone B

Curvularol

An organic heterotricyclic compound that is isolated from the fermentation broth of Curvularia sp. RK97-F166. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

Sardonialactone A

3-Hydroxy-4-(3-methyl-2-butenyl)bibenzyl

3beta,9alpha-Dihydroxycinnamolide

Ivambrin

ISOLACTARORUFIN

[4]-Isogingerol

Massarinolin B

Sydnic acid

Sydonic acid

1-Epierivanin

(11S)-1beta,3alpha,6alpha-trihydroxyeudesm-4(14)-en-12-oic acid gamma-lactone

Pernetic acid E

Isogallicadiol

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

1-Epiartemin

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

1-Epialkhanol

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

Arsanin

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

9beta-Hydroxy-4beta,11alpha,13,15-tetrahydrozaluzanin C

[3R-(3alpha,3abeta,6alpha,6abeta,9abeta,9balpha)]-Decahydro-6-hydroxy-6-(hydroxymethyl)-3-methyl-9-methylene-azuleno[4,5-b]furan-2(3H)-one

8beta-Hydroxysambucoin

2,2,4,4-Tetramethyl-6-(2-methyl-1-oxobutyl)-1,3,5-cyclohexanetrione

Dentalactone

Zedoalactone C

8-methoxy-9-O-isobutyrylthymol

A natural product found in Eupatorium cannabinum subspecies asiaticum.

Lauryl sulfate

D013501 - Surface-Active Agents Annotation level-3 CONFIDENCE standard compound; INTERNAL_ID 2407 CONFIDENCE standard compound; INTERNAL_ID 4066 CONFIDENCE standard compound; INTERNAL_ID 8761

TRIISOBUTYL PHOSPHATE

tris(2-methylpropyl) phosphate

CONFIDENCE standard compound; INTERNAL_ID 2468 CONFIDENCE standard compound; INTERNAL_ID 8808 CONFIDENCE standard compound; INTERNAL_ID 8248 CONFIDENCE standard compound; INTERNAL_ID 4188

TRIMETAZIDINE

MCULE-5872033859

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

STROBILACTONE A

(5R,5aS,9aS)-5,9b-Dihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-1(3H)-one

CCG-102628

4beta,10beta-dihydroxy-1alpha(H),5alpha(H)-guai-11(13)-en-8alpha,12-olide

(11R)-11,13-dihydrotatridin-B|11,12-dihydrotatridin B

laurefurenyne D

8,9-dihydroxy-3,9-dimethyl-6-methylenedecahydroazuleno[4,5-b]furan-2(3h)-one

L-Sorbitol permethyl

1??,4??-Epoxy-5??-hydroxy-10??H-xantha-11(13)-en-12,8??-olide

5alpha,9beta-dihydroxyeudesm-4(15),11(13)-dien-12-oic acid

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

(4alpha,6alpha,9alpha,11alpha)-4,8-Dihydroxy-11(13)-eudesmen-12,6-olide

USTUSORANE E

Bakkenolide III

12-hydroxy-6-oxo-6,7-secobakk-7(11)-en-8,12-olide

6beta,10beta-dihydroxyeremophil-7(11)-en-12,8alpha-olide

DTXSID201008007

C15H22O4

Rugosal D

SCHEMBL10017467

3alpha,6alpha-dihydroxy-8alphaH-7(11)-eremophilen-12,8-olide

Shonachalin C

macrophyllilactone D

CHEMBL2296057

O1-Me,O3-(3-methyl-2-butenyl)-3,5-Dihydroxy-4-methyl-1,2-benzenedimethanol

(3R,4S,5R,10S,11S)-3-hydroxy-8-oxo-6-eremophilen-12-oic acid

J3.631.117G

aogacillin B

(3aR,4S,5R,5aR,9aR,9bS)-1,2,3a,4,5,5a,6,7,9a,9b-decahydro-5,8-dimethyl-1-methylidenenaphto(2,1-b)furane-3a,4,9b-triol|lyophyllanetriol A

(3S,3aR,4aR,5R,7aS,9S,9aR)-decahydro-5,9-dihydroxy-3,5-dimethyl-8-methylideneazuleno[6,5-b]furan-2(3H)-one|4alpha,9alpha-dihydroxy-1betaH,11alphaH-guai-10(14)-en-12,8alpha-olide

6beta,9beta-dihydroxyeremophil-7(11)-en-(12,8alpha)-olide

osterivolone D

1alpha,7alpha-dihydroxyconfertifolin

nambinone B

(1R,4R,5S,6R,7R,8S,11S)-8,15-dihydroxyguaia-10(14)-en-6,12-olide

(6S,10S)-6,10-dihydroxy-7,8-seco-2,8-cyclo-muurol-4(5),7(11)-diene-12-oic acid

enokipodin E

6-oxodamsinic acid

DB-089442

ambroxetane

4alpha,15-dihydroxy-5alpha,8betaH-eudesman-7(11)-en-8alpha,12-olide|atractylenolide IV

11Hbeta-11,13-dihydroxymicrantholide

corialactone C

calamusin A

arecoic acid F

nardochinone A

1-hydroxy-1-(1-oxo-3-methyl-2-butenyl)-2-acetoxy-3,5,5-trimethyl-3-cyclopentene

calamusin B

2-hydroxycoprinolone

ethyl-2-hydroxy-4-methoxy-6-pentylbenzoate

1,5-epoxy-4-hydroxyguai-11(13)-en-12-oic acid|rel-(3R,3aR,5R,8S,8aR)-hexahydro-3-hydroxy-3,8-dimethyl-alpha-methylene-1H,4H-3a,8a-epoxyazulene-5-acetic acid

(4S,5R,8R,10S)-1-nor-10-hydroxy-8-methoxyeremophil-7(11)-en-12, 8-olide

(1aS,1bR,4S,4aR,5aR,6R,8aS,8bR)-decahydro-6-hydroxy-4,6,8b-trimethyloxireno[7,8]azuleno[6,5-b]furan-3(1bH)-one|9beta,10beta-epoxy-4alpha-hydroxy-1betaH,11alphaH-guaian-12,8alpha-olide

6,7,13-trihydroxy-alpha-ylang-5-one|dendronephthol C

1beta-Hydroxyarbusculin A

ketopelenolide D

ketopelenolide C

11alphaH,13-dihydroburrodin|2alpha-hydroxy-11alpha,13-dihydroconfertin

(+)-(3R,4aS,8aS*)-3-[(E)-4-hydroxybut-2-en-2-yl]-5,5,8a-trimethyl-3,4,4a,5-tetrahydrobenzo[c][1,2]dioxin-6(8aH)-one|okundoperoxide

(+)-(3R*,4aS*,8aS*)-3-[(E)-4-hydroxybut-2-en-2-yl]-5,5,8a-trimethyl-3,4,4a,5-tetrahydrobenzo[c][1,2]dioxin-6(8aH)-one|okundoperoxide

10alpha-hydroxy-10(14),11beta(13)-tetrahydrozaluzanin C

4E,10E-3beta,11beta-dihydroxygermacra-4(5),10(1)-dien-12,6alpha-olide

NSC689629

3,8,8-Trimethyl-4,5,8,9,10,11-hexahydrophenanthro[10,1-bc]pyran

1beta,5alpha-dihydroxy-11alphaH-eudesma-4(15)-en-12,8beta-olide|1beta-hydroxy-7alphaH,11alphaH-eudesm-4(15)-en-12,8beta-lactone

(+)-(1S,3S)-1,3-dihydroxy-gamma-ionylideneacetate|(1R.3S)-(2Z,4E)-1,3-dihydroxy-gamma-ionylideneacetic acid|(1S,2Z,3S,4E)-5-(1,3-Dihydroxy-2,2-dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadienoic acid

(+)-(1S,3S)-1,3-dihydroxy-gamma-ionylideneacetate|(1R.3S)-(2Z,4E)-1,3-dihydroxy-gamma-ionylideneacetic acid|(1S,2Z,3S,4E)-5-(1,3-Dihydroxy-2,2-dimethyl-6-methylenecyclohexyl)-3-methyl-2,4-pentadienoic acid

clavicorolide A

6alpha-hydroxy-4alpha,5beta-epoxy-11alphaH-germacr-1(10)E-en-12,8alpha-olide

eremoligularin

3beta-hydroxy-4alpha(3)-dihydrosantamarine|4alpha(15)-dihydroridentin B

3,8-Dimethyl-4a,5-dihydroxy-5-isopropyl-4a,5,8,8a-tetrahydronaphthalene-2,6(1H,7H)-dione

(3S,10S)-epoxy-1beta-hydroxy-(4Z)-germacren-12,6alpha-olide|caruifolin A

Pinnatifidin, 1alpha,2-dihydroxy

2,3-Dihydroxypterodontic acid

(11S)-10alpha-hydroxy-3-oxo-4betaH-guaiano-12,6alpha-lactone|(3S,3aS,6R,6aR,9S,9aR,9bS)-6-hydroxy-3,6,9-trimethyl-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8(3H,9bH)-dione|10alpha-hydroxy-3-oxo-1,5,7alphaH,4,6,11betaH-guaian-6,12-olide|3-Hydroxyimino-dihydro-isophoto-alpha-santonic lacton|4alpha-methyl-dihydroisophoto-alpha-santonin lactone|dihydroisophotosantonin lactone|Dihydroisophotosantoninlacton

(11S)-10alpha-hydroxy-3-oxo-4betaH-guaiano-12,6alpha-lactone|(3S,3aS,6R,6aR,9S,9aR,9bS)-6-hydroxy-3,6,9-trimethyl-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8(3H,9bH)-dione|10alpha-hydroxy-3-oxo-1,5,7alphaH,4,6,11betaH-guaian-6,12-olide|3-Hydroxyimino-dihydro-isophoto-alpha-santonic lacton|4alpha-methyl-dihydroisophoto-alpha-santonin lactone|dihydroisophotosantonin lactone|Dihydroisophotosantoninlacton

mucrotan

(11Xi)-1,6beta-dihydroxy-4-oxo-10alphaH-ambrosan-12-oic acid-6-lactone|(11Xi)-1,6beta-Dihydroxy-4-oxo-10alphaH-ambrosan-12-saeure-6-lacton|dihydrocoronopilin|tetrahydroparthenin

repraesentin C

5-hydroxy-2,2,6,6-tetramethyl-4-(2-methylbutanoyl)cyclohex-4-ene-1,3-dione

3-desoxy-8-epi-hymenoxon

Herbolide I

2-heptyl-3,6-dihydroxy-4-methoxybenzaldehyde|fordianol

Hybrifarin

(1R,4S,5R,7R,8R,10S)-1,5-dihydroxyeudesma-11(13)-en-12,8-olide

Humulinic acid C

Isobutyric acid 2-(1-methyl-1-methoxy-2-hydroxyethyl)-5-methylphenyl ester

Zedoarofuran

3beta-Hydroxybalchanolide

fascicularone E

(8betaOH,10beta)-8,10-Dihydroxy-7(11)-eremophilen-12,8-olide|8beta,10beta-dihydroxyeremophil-7(11)-en-8alpha,12-olide|8beta,10beta-dihydroxyeremophilenolide|8beta,10beta-dihydroxyeremophyl-7(11)-en-12,8alpha-olide

(8betaOH,10beta)-8,10-Dihydroxy-7(11)-eremophilen-12,8-olide|8beta,10beta-dihydroxyeremophil-7(11)-en-8alpha,12-olide|8beta,10beta-dihydroxyeremophilenolide|8beta,10beta-dihydroxyeremophyl-7(11)-en-12,8alpha-olide

7-Tigloyl-(4R*,5R)-5,7-Dihydroxy-p-menth-1(6)-en-2-one

(1beta,6alpha)-1,6,14-trihydroxyeudesm-3-en-12-oic acid gamma-lactone|rel-(3R,3aR,5aS,6S,9aR,9bR)-3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-9-(hydroxymethyl)-3,5a-dimethylnaphtho[1,2-b]furan-2(3H)-one

ent-11,14-dihydroxy-3-oxo-driman-12-oic acid-11-lactone|ent-11,14-Dihydroxy-3-oxo-driman-12-saeure-11-lacton

Epoxycantabronic acid

Versicolactone B|Yindailactone C

1beta,3alpha-dihydroxy-11aH-eudesma-4(5)-en-12,8beta-olide

2alpha,11-dihydroxy-1(10)-tremulen-5,12-olide

apo-9-Fucoxanthinone

(3aR,3bS,4R,5aS,6aR,7S,9aS)-octahydro-4-hydroxy-1,3b,7-trimethyl-4H-oxireno[1,8a]azuleno[4,5-b]furan-2(1H)-one

3alpha-hydroxy-11alphaH,13-dihydrodamsin

(-)-(5S,6S,7S,9R,10S*)-7-hydroxy-5,7-epidioxycadinan-3-ene-2-one

(-)-(5S*,6S*,7S*,9R*,10S*)-7-hydroxy-5,7-epidioxycadinan-3-ene-2-one

SCHEMBL8393038

1,14-dihydroxy-4alphaH-1,10-secoeudesma-5(10),11(13)-dien-12,8beta-olide

8,15-dihydroxy-gamma-butyrolactone dendrolasin

3-(3,4-dihydrophenyl)propyl 4-methylvalerate

1alpha,4alpha-dihydroxyeudesm-2-en-5alpha,6beta,7alpha,11betaH-12,6-olide|Erivanin

Semicarbazone-1,3-Diphenyl-1-propanone

methyl 12-acetoxy-5(Z),8(E),10(E)-dodecatrienoate

daldinin B

pulicazine

14-Hydroxysterpuric acid

8alpha-hydroxy-1,4beta-epoxy-10-epieudesman-5alpha,6beta,7alpha,11betaH-12,6-olide|Shonachalin B

2beta-hydroxy-11beta,13-dihydrodouglanin

1(10),4(5)-dien-6alpha-hydroxy-11alpha-hydroxymethylene-6beta,8beta,11beta(H),5alpha,7alpha(H)-germacr-8,12-olide|13alpha-hydroxymethylenedeacetyllaurenobiolide

Apodophyllone

MCULE-1511357927

2-(3-methylbut-2-enyl)-5-(2-phenylethyl)phenol

(2S,5R)-2-(2-hydroxypropan-2-yl)-5,9-dimethyl-1-oxaspiro[5.5]undec-8-ene-7,10-dione

Homoembelin

2,5-dihydroxy-3-nonylcyclohexa-2,5-diene-1,4-dione

[2-(hydroxymethyl)-3-methoxy-4-methyl-5-(3-methylbut-2-enoxy)phenyl]methanol

NCGC00179724-02![2-(hydroxymethyl)-3-methoxy-4-methyl-5-(3-methylbut-2-enoxy)phenyl]methanol

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

NCGC00384597-01!3a,8-dihydroxy-3,5a,9-trimethyl-4,5,6,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2-one

3-hydroxy-4-(2-hydroxy-6-methylheptan-2-yl)benzoic acid

NCGC00180240-02!3-hydroxy-4-(2-hydroxy-6-methylheptan-2-yl)benzoic acid

C12-AS (TENTATIVE)

TENTATIVELY IDENTIFIED SPECTRUM ONLY!!!!!!!!!; Extracted (without noise removal) from ZWI_N: mz265_15_rt18_47_HCD60_C12-AS; CONFIDENCE Tentative identification: best match only (Level 3)

C15H22O4_2-[(3S,3aR,5R,7aS)-3a-Acetyl-3-hydroxy-7a-methyloctahydro-1H-inden-5-yl]acrylic acid

NCGC00180350-02_C15H22O4_2-[(3S,3aR,5R,7aS)-3a-Acetyl-3-hydroxy-7a-methyloctahydro-1H-inden-5-yl]acrylic acid

C15H22O4_2,8-Dihydroxy-5,5,8-trimethyl-11-oxatetracyclo[7.3.1.0~1,9~.0~3,7~]tridecan-10-one

NCGC00385871-01_C15H22O4_2,8-Dihydroxy-5,5,8-trimethyl-11-oxatetracyclo[7.3.1.0~1,9~.0~3,7~]tridecan-10-one

C15H22O4_3a,7-Ethano-3aH-indene-4-carboxylic acid, octahydro-6-hydroxy-3,8,8-trimethyl-2-oxo

NCGC00381369-01_C15H22O4_3a,7-Ethano-3aH-indene-4-carboxylic acid, octahydro-6-hydroxy-3,8,8-trimethyl-2-oxo-

C15H22O4_11-(Hydroxymethyl)-2,11-dimethyl-3-oxotricyclo[4.3.2.0~1,5~]undecane-9-carboxylic acid

NCGC00380321-01_C15H22O4_11-(Hydroxymethyl)-2,11-dimethyl-3-oxotricyclo[4.3.2.0~1,5~]undecane-9-carboxylic acid

C15H22O4_(3aS,4S,7aR)-4-Hydroxy-5-[(2S)-5-hydroxy-2-pentanyl]-6-methyl-3-methylene-3a,4,7,7a-tetrahydro-1-benzofuran-2(3H)-one

NCGC00385885-01_C15H22O4_(3aS,4S,7aR)-4-Hydroxy-5-[(2S)-5-hydroxy-2-pentanyl]-6-methyl-3-methylene-3a,4,7,7a-tetrahydro-1-benzofuran-2(3H)-one

C15H22O4_Naphtho[2,3-b]furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9,9a-dihydroxy-3,4a,5-trimethyl-, (4aR,5S)

NCGC00380735-01_C15H22O4_Naphtho[2,3-b]furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9,9a-dihydroxy-3,4a,5-trimethyl-, (4aR,5S)-

C15H22O4_Azuleno[5,6-c]furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-4,8-dihydroxy-6,6,8-trimethyl

NCGC00385131-01_C15H22O4_Azuleno[5,6-c]furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-4,8-dihydroxy-6,6,8-trimethyl-

C15H22O4_5,8-Dihydroxy-3,5,8-trimethyl-4a,5,6,7,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2(4H)-one

NCGC00385649-01_C15H22O4_5,8-Dihydroxy-3,5,8-trimethyl-4a,5,6,7,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2(4H)-one

C15H22O4_Naphtho[1,2-c]furan-3(1H)-one, 5,5a,6,7,8,9,9a,9b-octahydro-5-hydroxy-6-(hydroxymethyl)-6,9a-dimethyl

NCGC00385633-01_C15H22O4_Naphtho[1,2-c]furan-3(1H)-one, 5,5a,6,7,8,9,9a,9b-octahydro-5-hydroxy-6-(hydroxymethyl)-6,9a-dimethyl-

C15H22O4_2-[(1E,3E)-1,3-Hexadien-1-yl]-5-(3-hydroxy-2-methoxypropyl)-2-methyl-3(2H)-furanone

NCGC00385923-01_C15H22O4_2-[(1E,3E)-1,3-Hexadien-1-yl]-5-(3-hydroxy-2-methoxypropyl)-2-methyl-3(2H)-furanone

C15H22O4_1,9b-Dihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-3(1H)-one

NCGC00380941-01_C15H22O4_1,9b-Dihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-3(1H)-one

3-hydroxy-4-(2-hydroxy-6-methylheptan-2-yl)benzoic acid

1,9b-dihydroxy-6,6,9a-trimethyl-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-3-one

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

5,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one

(1S,8R,9R)-8-hydroxy-4-(propan-2-ylidene)-10-oxatricyclo[7.2.1.01,5]dodecane-8-carboxylic acid

Verrucarol

Verrucarol, (+/-)-

D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

Tri-N-butyl phosphate

MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; STCOOQWBFONSKY-UHFFFAOYSA-N_STSL_0219_Tri-N-butyl phosphate_0002fmol_190326_S2_LC02MS02_076; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.

Sydonic acid

zinniol_major

(1S,8R,9R)-8-hydroxy-4-(propan-2-ylidene)-10-oxatricyclo[7.2.1.01,5]dodecane-8-carboxylic acid_major

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

1,4-dihydroxy-6,6,9a-trimethyl-4,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzofuran-3-one_major

5,9-dihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one_major

STROBILACTONE A_minor

1,9b-dihydroxy-6,6,9a-trimethyl-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-3-one_major

STROBILACTONE A_major

4-Gingerol

5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pentanoic acid (Gemfibrozil M1)

5-[2-(hydroxymethyl)-5-methylphenoxy]-2,2-dimethyl-Pentanoic acid (Gemfibrozil M4)

(+)-Blennin D

Humulinic acid A

3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)-2-(3-methylbutanoyl)cyclopent-2-en-1-one

Adhumulinic acid

4-hydroxy-5-(3-methylbut-2-en-1-yl)-2-(2-methylbutanoyl)cyclopentane-1,3-dione

(6Z)-1,7-diphenylhept-6-en-3-ol

trans－1,7－Diphenyl－5-hydroxy-1－hepten

Blennin D

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

Absindiol

4,8-dihydroxy-3,6-dimethyl-9-methylidene-dodecahydroazuleno[4,5-b]furan-2-one

(R)-Athanagrandione

1-(furan-3-yl)-4-hydroxy-4,8-dimethylnonane-1,6-dione

artemin

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

7-Hydroxymyoporone

1-(furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione

6beta,8beta-Dihydroxyeremophilenolide

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

3,14-Dihydroxy-11,13-dihydrocostunolide

9-hydroxy-6-(hydroxymethyl)-3,10-dimethyl-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-2-one

Arlatin

6,6a-dihydroxy-3,6,9-trimethyl-2H,3H,3aH,4H,5H,6H,6aH,7H,9aH,9bH-azuleno[4,5-b]furan-2-one

1a,15-Dihydroxymarasmene

(2S,6S,12R,14R)-5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0^{1,6}.0^{12,15}]pentadec-8-ene-2,14-diol

3a,15-Dihydroxymarasmene

5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.0^{1,6}.0^{12,15}]pentadec-8-ene-4,14-diol

Alhanol

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

(1alpha,4alpha,5beta,6alpha,11betaH)-1,4-Epoxy-5-hydroxy-10(14)-germacren-12,6-olide

2-hydroxy-1,6-dimethyl-10-methylidene-4,14-dioxatricyclo[9.2.1.0^{3,7}]tetradecan-5-one

1a-Hydroxyarbusculin a

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

Ipomeamaronol

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

7-Hydroxytrichodermol

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-ene-3,11-diol

4'-Dihydroabscisic acid

(2E,4E)-5-(1,4-dihydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid

Ipomeamaronolide

2,3,4,5-Tetrahydro-5-methyl-5-(4-methyl-2-oxopentyl)-[2,3'-bifuran]-2'(5'H)-one, 9CI

Isoleptospermone

2,2,4,4-Tetramethyl-6-(2-methyl-1-oxobutyl)-1,3,5-cyclohexanetrione

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

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

cumanin

(3aR,4aS,5R,6S,8S,9aR)-5,6-Dihydroxy-4a,8-dimethyl-3-methylenedecahydroazuleno[6,5-b]furan-2(3H)-one

1-(2-methoxyphenoxy)-3-piperazin-1-ylpropan-2-ol

4-[(8-Hydroxyoctyl)oxy]benzoic acid

2,5,8,11,14,17-Hexaoxaoctadecane

COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

4-ACETYL-4-N-PENTYLBIPHENYL

bis(2,4,6-trimethylphenyl)methanone

1-bromo-1,1,2,2-tetradeuteriotridecane

C13H23BrD4 (266.154708912)

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3- cyclohexene-1-carboxylic acid methyl ester

1,2,3,4-Tetrahydroisoquinoline

(S)-N-(Butoxycarbonyl)-4-aminophenylalaninol

Glyoxal bis(N-methyl-N-phenylhydrazone)

2-[[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]oxirane

BIS(DIISOPROPYLAMINO)CHLOROPHOSPHINE

C12H28ClN2P (266.1678528)

3-(N,N-Dimethoxyethyl)amino acetanilide

2-Benzyl-2,7-diazaspiro[4.5]decane hydrochloride (1:1)

C15H23ClN2 (266.1549668)

1-[(2,4,6-Trimethoxyphenyl)methyl]piperazine dihydrochloride

(E)-but-2-enedioic acid,(4E)-octa-1,4,7-triene,prop-1-ene

C16H23FO2 (266.16819899999996)

2-FLUORO-4-OCTYLOXYACETOPHENONE

3,4-Bis(2-methylpropyloxy)benzeneboronic acid

mono-n-dodecyl phosphate

1-(2,2,6-TRIMETHYLCYCLOHEXYL)-3-HEXANOL

[2-amino-2-(3-methoxy-phenyl)-ethyl]-carbamic acid tert-butyl ester

tert-butyl 4-(imidazol-1-ylmethyl)piperazine-1-carboxylate

C13H22N4O2 (266.1742672)

(R)-(+)-Atenolol

(R)-(+)-Atenolol is the less active enantiomer of the (R,S)-atenolol. (R,S)-atenolol is a β-adrenergic receptor antagonist[1][2].

3-AMINO-3-[4-(3-DIMETHYLAMINO-PROPOXY)-PHENYL]-PROPIONIC ACID

humulinic acid

1,2-dichlorotetradecane

C14H28Cl2 (266.1567948)

TERT-BUTYL 4-(5-AMINO-1H-PYRAZOL-3-YL)PIPERIDINE-1-CARBOXYLATE

C13H22N4O2 (266.1742672)

esatenolol

Benzeneacetamide, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, (S)-

p-Heptanoylbiphenyl

3,6,9,12,15-pentaoxaheptadecan-1-ol

[2-amino-2-(2-methoxy-phenyl)-ethyl]-carbamic acid tert-butyl ester hydrochloride

2-AMINOBENZALDEHYDE-ETHYLENE-DIIMINE

4,8-Dihydroxyeudesm-7(11)-en-12,8-olide

2-[(1R,2R,3S,4R)-2-Formyl-4-methyl-3-(3-oxobutyl)cyclohexyl]acryl ic acid

4-Amino-1-(1-Boc-4-piperidyl)pyrazole

C13H22N4O2 (266.1742672)

methyl (E)-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]pent-2-enoate

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

1,4-Dioxaspiro[4,5]dec-7-en-8-boronic acid pinacol ester

1,4-bis-4-(3,5-dimethyl)-pyrazolylbenzene

2-[3-(Boc-aMino)propyloxyl]aniline

(S)-1-(3-(Ethyl(methyl)carbamoyloxy)phenyl)-N,N-dimethylethanamine oxide

7-(3-hydroxy-5-oxo-1-cyclopenten-1-yl)-(5Z)--Heptenoic acid-1-Methylethyl ester

8-(2-furanyl)-8-hydroxy-(5Z) -Octenoic acid-1-Methylethyl ester

(4-((4-ethylpiperazin-1-yl)Methyl)-2-fluorophenyl)boronic acid

C13H20BFN2O2 (266.1601782)

methyl (2R,3S)-2-ethyl-7,7-dimethyl-5-oxo-3,4,6,8-tetrahydro-2H-chromene-3-carboxylate

methyl (2S,3S)-2-ethyl-7,7-dimethyl-5-oxo-3,4,6,8-tetrahydro-2H-chromene-3-carboxylate

1-[(3,4,5-Trimethoxyphenyl)methyl]piperazine

(2,4-Dibutoxyphenyl)boronic acid

4,4,5,5-TETRAMETHYL-2-(1,4-DIOXASPIRO[4.5]DEC-7-EN-7-YL)-1,3,2-DIOXABOROLANE

8-BENZYL-2,8-DIAZASPIRO[4.5]DECANE HYDROCHLORIDE

C15H23ClN2 (266.1549668)

deoxyartemisinin

1-(4-METHOXY-PHENOXY)-3-PIPERAZIN-1-YL-PROPAN-2-OL

2,5-Diethoxy-4-morpholinoaniline

1-(2,4,5-Trimethoxybenzyl)piperazine

Propyleneglycol propoxylated ethoxylated polymer

2-(1,4,5,7-Tetramethyl-pyrrolo[3,4-d]pyridazin-6-yl)-phenylamine

(1S,5R,6S,7S,8S,10R,11R)-6-hydroxy-4-oxopseudoguai-12,8-olide

A pseudoguaianolide with anti-inflammatory activity isolated from the aerial parts of Inula hupehensis

Isonordoperoxide

A sesquiterpenoid that is 1,4,5,6,7,8-hexahydro-4,7-epidioxyazulen-3(2H)-one substituted by a hydroxy group at position 8, methyl groups at positions 1 and 4 and an isopropyl group at position 7 (the (1R,4R,7S,8S stereoisomer). Isolated from Nardostachys chinensis, it exhibits antimalarial activity.

(3aR,4R,6aR)-rel-dihydro-3-methylene-4-octyl-furo[3,4-b]furan-2,6(3H,4H)-dione

4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 1,6,7,8,9,9a-hexahydro-1-ethyl-6-methyl-4-oxo-, ethyl ester

Trimethyl[(6-phenoxyhexyl)oxy]silane

C15H26O2Si (266.1701976)

practolol

Bucolome

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

AI3-00399

InChI=1\C12H27O4P\c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3\h4-12H2,1-3H

D020011 - Protective Agents > D011837 - Radiation-Protective Agents

5,8-Dihydroxy-3,5,8-trimethyl-4a,5,6,7,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2(4h)-one

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

Tsugicoline A

4alpha-Hydroxydihydroilluidin M

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

2-Butyloctyl hydrogen sulfate

(2Z,4E)-5-[(1S,4S)-1,4-dihydroxy-2,2-dimethyl-6-methylidenecyclohexyl]-3-methylpenta-2,4-dienoic acid

Potassium myristate

C14H27KO2 (266.1648022)

2-[(3S,3aR,5R,7aS)-3a-acetyl-3-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-5-yl]prop-2-enoic acid

(+)-(7S)-sydonic acid

A sesquiterpenoid that is benzoic acid substituted by a hydroxy group at position 3 and a (2S)-2-hydroxy-6-methylheptan-2-yl group at position 4. It has been isolated from the sea fan derived fungus Aspergillus sydowii.

1beta-hydroxy arbusculin A

A sesquiterpene lactone that is the 1beta-hydroxy derivative of arbusculin A. Isolated from Saussurea lappa, it exhibits inhibitory activity against melanogenesis.

(2R,3R,4S,5R)-2-({[(1R)-2-Hydroxy-1-phenylethyl]amino}methyl)-5-methylpyrrolidine-3,4-diol

11-(Hydroxymethyl)-2,11-dimethyl-3-oxotricyclo[4.3.2.01,5]undecane-9-carboxylic acid

2-[(1E,3E)-hexa-1,3-dienyl]-5-(3-hydroxy-2-methoxypropyl)-2-methylfuran-3-one

Pentanoic acid, 5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-

1-Ethoxy-3-(2-methoxy-4-prop-2-enylphenoxy)-2-propanol

Nardoperoxide