Exact Mass: 224.10549200000003
Exact Mass Matches: 224.10549200000003
Found 500 metabolites which its exact mass value is equals to given mass value 224.10549200000003,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
1-Methyl-6-phenyl-1H-imidazo[4,5-b]pyridin-2-amine
1-Methyl-6-phenyl-1H-imidazo[4,5-b]pyridin-2-amine is a food-related mutagen, reported to be the most abundant heterocyclic amine found in cooked meat and fish. Food-related mutagen, reported to be the most abundant heterocyclic amine found in cooked meat and fish CONFIDENCE standard compound; INTERNAL_ID 8317 CONFIDENCE standard compound; INTERNAL_ID 2293 CONFIDENCE standard compound; INTERNAL_ID 9 D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens
Olivetolic acid
A member of the class of benzoic acids that is salicylic acid in which the hydrogens ortho- and para- to the carboxy group are replaced by a pentyl and a hydroxy group, respectively. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Dhelwangin
Dhelwangin is an aromatic ketone. Dhelwangin is a natural product found in Pogostemon cablin with data available. Dhelwangin is found in herbs and spices. Dhelwangin is isolated from leaves of Pogostemon cablin (patchouli Pogostone is isolated from patchouli oil?with anti-bacterial and anti-cancer activities.?Pogostone inhibits both gram negative and gram positive bacteria, also show inhibitory effect on corynebacterium xerosis with a MIC value of 0.098 μg/ml [2].?Pogostone induces cell apoptosis and autophagy[2]. Pogostone is isolated from patchouli oil?with anti-bacterial and anti-cancer activities.?Pogostone inhibits both gram negative and gram positive bacteria, also show inhibitory effect on corynebacterium xerosis with a MIC value of 0.098 μg/ml [2].?Pogostone induces cell apoptosis and autophagy[2].
Butalbital
Butalbital, 5-allyl-5-isobutylbarbituric acid, is a barbiturate with an intermediate duration of action. It has the same chemical formula as talbutal but a different structure. Butalbital is often combined with other medications, such as acetaminophen or aspirin, and is commonly prescribed for the treatment of pain and headache. [Wikipedia] C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
Diplosporin
Epi-diplosporin is a metabolite of Diplodia macrospora isolated from infected maize. Metabolite of Diplodia macrospora isolated from infected maize
3',4',5'-Trimethoxycinnamyl alcohol
3,4,5-Trimethoxycinnamyl alcohol is found in herbs and spices. 3,4,5-Trimethoxycinnamyl alcohol is a constituent of Myristica fragrans (nutmeg) and other plant species. Constituent of Myristica fragrans (nutmeg) and other plant subspecies 3,4,5-Trimethoxycinnamyl alcohol is found in herbs and spices.
N-Methoxy-1-vinyl-beta-carboline
C14H12N2O (224.09495819999998)
N-Methoxy-1-vinyl-beta-carboline is an alkaloid from Picrasma excelsa (Jamaican quassiawood
Isoacoramone
Constituent of Acorus calamus (sweet flag). Isoacoramone is found in herbs and spices and root vegetables. Isoacoramone is found in herbs and spices. Isoacoramone is a constituent of Acorus calamus (sweet flag).
Temurin
Temurin is a methyl derivative of uric acid, found occasionally in human urine. Temurin is one of the purine components in urinary calculi. Methylated purines originate from the metabolism of methylxanthines (caffeine, theophylline and theobromine). Methyluric acids are indistinguishable from uric acid by simple methods routinely used in clinical laboratories, requiring the use of high-performance liquid chromatography (HPLC). Purine derivatives in urinary calculi could be considered markers of abnormal purine metabolism. The content of a purine derivative in stone depends on its average urinary excretion in the general population, similarity to the chemical structure of uric acid, and content of the latter in stone. This suggests that purines in stones represent a solid solution with uric acid as solvent. It is also plausible that methylxanthines, ubiquitous components of the diet and drugs, are involved in the pathogenesis of urolithiasis. (PMID: 11712316, 15833286, 3506820, 15013152). Isolated from tea
Acoramone
Acoramone is found in herbs and spices. Acoramone is a constituent of the oil of Acorus calamus (sweet flag)
Vanillin 1,2-butylene glycol acetal
Vanillin 1,2-butylene glycol acetal is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
2-Ethoxy-4-(4-methyl-1,3-dioxolan-2-yl)phenol
2-Ethoxy-4-(4-methyl-1,3-dioxolan-2-yl)phenol is present in food as an artifact arising from reaction of
2,6-Diamino-9-(2-hydroxyethoxymethyl)purine
C8H12N6O2 (224.10216920000002)
8-(2-Hydroxyethyl)theophyline
Enallylpropymal
56W6M8HQ2G
Senkyunolide h is a member of 2-benzofurans. (3Z,6R,7S)-3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one is a natural product found in Ligusticum striatum, Angelica sinensis, and other organisms with data available. Senkyunolide H is a natural compound isolated from Ligusticum chuanxiong Hort[1]. Senkyunolide H is a natural compound isolated from Ligusticum chuanxiong Hort[1].
12PJ07292V
1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-, (3Z,6R,7R)-rel- is a natural product found in Ligusticum striatum, Angelica sinensis, and other organisms with data available. See also: Angelica sinensis root oil (part of). Senkyunolide I, isolated from Ligusticum chuanxiong Hort, is an anti-migraine compound. Senkyunolide I protects rat brain against focal cerebral ischemia-reperfusion injury by up-regulating p-Erk1/2, Nrf2/HO-1 and inhibiting caspase 3[1][2]. Senkyunolide I, isolated from Ligusticum chuanxiong Hort, is an anti-migraine compound. Senkyunolide I protects rat brain against focal cerebral ischemia-reperfusion injury by up-regulating p-Erk1/2, Nrf2/HO-1 and inhibiting caspase 3[1][2].
3-Ethoxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone
2-Hydroxy-4-(2-hydroxyethoxy)-2-methylpropiophenone
Vinylbital
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
7-(2-Hydroxyethyl)theophylline
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu); Flow Injection CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu)
(E,2S,3R)-5-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-4-ene-2,3-diol
1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl-1-propanone
(3R,4S)-3,4-dihydroxy-6-methoxy-2,2-dimethyl-chroman|trans-3,4-Dihydroxy-6-methoxy-2,2-dimethyl-chroman
Et ester-6-Ethyl-2,4-dihydroxy-3-methylbenzoic acid
4-Methyl-5-(1-methyl-2-formyloxypropyl)-resorcin|O2-Formyl-3-(3,5-Dihydroxy-2-methylphenyl)-2-butanol
5-[5-[(R)-1-methoxyethyl]furan-2-yl]dihydrofuran-2(3H)-one
(4R)-2,4-dimethyl-4-(1-acetyl-3-oxobutyl)-2-butenolide
2-ethoxy-1-(4-hydroxy-3-methoxy-phenyl)-propan-1-one
butyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dienyl)acetate
(3SR,4RS)-6-(hydroxymethyl)-2,2-dimethyl-3,4-dihydro-2H-chromene-3,4-diol
(+)-(7S,8R)-4-hydroxy-3-methoxy-1,2,3,4,5,6,7-heptanorlign-8-one
4-(4-hydroxy-3-methylbutyloxy)benzoic acid|turraeanthin C
2,6-dimethylheptyl hydrogen sulfate
An alkyl sulfate that is the sulfuric ester of 2,6-dimethylheptan-1-ol.
3-ethoxy-1-(4-hydroxy-3-methoxy-phenyl)-propan-1-one
6R-hydroxy-3-[E-3-hydroxy-3-methyl-but-1-enyl]-6-methylcyclohex-2-ene-1,4-dione|acrimine B
TOB-10
C14H12N2O (224.09495819999998)
Dehydrocrenatine is a natural product found in Picrasma quassioides and Picrasma javanica with data available.
Atenolol-desisopropyl
A member of the class of ethanolamines that is 2-aminoethanol substituted by a [4-(2-amino-2-oxoethyl)phenoxy]methyl group at position 1. It is a metabolite of the drug atenolol. CONFIDENCE standard compound; EAWAG_UCHEM_ID 2670 EAWAG_UCHEM_ID 2670; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 2024
C12H16O4_(3Z)-3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1(3H)-one
C12H16O4_6H-2-Benzopyran-6-one, 1,7,8,8a-tetrahydro-7,8-dihydroxy-3,5,7-trimethyl-, (7S,8S,8aS)
C12H16O4_4-Pentene-2,3-diol, 5-[3-hydroxy-2-(hydroxymethyl)phenyl]-, (2S,3R,4E)
butalbital
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
(E,2S,3R)-5-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-4-ene-2,3-diol_major
N-Methoxy-1-vinyl-b-carboline
C14H12N2O (224.09495819999998)
Pogostone
Pogostone is isolated from patchouli oil?with anti-bacterial and anti-cancer activities.?Pogostone inhibits both gram negative and gram positive bacteria, also show inhibitory effect on corynebacterium xerosis with a MIC value of 0.098 μg/ml [2].?Pogostone induces cell apoptosis and autophagy[2]. Pogostone is isolated from patchouli oil?with anti-bacterial and anti-cancer activities.?Pogostone inhibits both gram negative and gram positive bacteria, also show inhibitory effect on corynebacterium xerosis with a MIC value of 0.098 μg/ml [2].?Pogostone induces cell apoptosis and autophagy[2].
tert-Butyl (2-(hydroxymethyl)pyridin-3-yl)carbamate
2-hydroxy-3-(4-methoxy-phenyl)-propionic acid ethyl ester
[3-(1H-benzimidazol-2-yl)phenyl]methanol
C14H12N2O (224.09495819999998)
1-(4-CHLORO-3-TRIFLUOROMETHYL-PHENYL)-PYRROLE-2,5-DIONE
6-(BENZYLOXY)-1H-PYRROLO[2,3-B]PYRIDINE
C14H12N2O (224.09495819999998)
(4-METHOXY-PYRIDIN-2-YL)-CARBAMIC ACID TERT-BUTYL ESTER
5-(4-METHYL-PIPERAZIN-1-YLMETHYL)-FURAN-2-CARBOXYLIC ACID
VINBARBITAL
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
2-(1H-indol-3-yl)-2-methylpropan-1-amine,hydrochloride
(2E)-1-(4-aminophenyl)-3-pyridin-3-ylprop-2-en-1-one
C14H12N2O (224.09495819999998)
Benzenamine,4-(5-methyl-2-benzoxazolyl)-
C14H12N2O (224.09495819999998)
5-(benzyloxy)-1H-pyrrolo[3,2-b]pyridine
C14H12N2O (224.09495819999998)
3-((4-CHLOROPIPERIDIN-1-YL)METHYL)-5-METHYLPYRIDINE
5-Methylthiophene-2-boronic acid pinacol ester
C11H17BO2S (224.10422520000003)
tert-butyl (6-(hydroxymethyl)pyridin-2-yl)carbamate
2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
C11H16N2OS (224.09832859999997)
(2-([1,1-BIPHENYL]-4-YL)VINYL)BORONIC ACID
C14H13BO2 (224.10085480000004)
4-Methoxy-2-(1-methylethoxy)benzoic acid methyl ester
7-(BENZYLOXY)-1H-PYRROLO[3,2-B]PYRIDINE
C14H12N2O (224.09495819999998)
4-(Benzyloxy)-1H-pyrrolo[2,3-b]pyridine
C14H12N2O (224.09495819999998)
Ethyl 4-acetyl-2-propyl-1H-imidazole-5-carboxylate
3-Methylthiophene-2-boronic acid pinacol ester
C11H17BO2S (224.10422520000003)
2-Methylthiophene-3-boronic acid pinacol ester
C11H17BO2S (224.10422520000003)
4-Methylthiophene-3-boronic acid pinacol ester
C11H17BO2S (224.10422520000003)
tert-Butyl (3-(hydroxymethyl)pyridin-2-yl)carbamate
tert-Butyl 4-formyl-3,5-dimethyl-1H-pyrazole-1-carboxylate
6-Methoxy-2-phenylimidazo[1,2-a]pyridine
C14H12N2O (224.09495819999998)
1-(2-Methoxyethyl)-2-pyrrolidinone
C14H12N2O (224.09495819999998)
3-(2-CYANO-ACETYL)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
6-(3-Pyridinyl)-3,4-dihydro-2(1H)-quinolinone
C14H12N2O (224.09495819999998)
5-amino-2-methyl-10h-acridin-9-one
C14H12N2O (224.09495819999998)
1,2-Ethanedione,1,2-diphenyl-, 1-hydrazone
C14H12N2O (224.09495819999998)
2,2-dimethyl-3-hydroxy-3-(p-methoxyphenyl)propionic acid
2-(4-Piperidinyl)-4-oxazolecarboxylic acid ethyl ester
5-Benzooxazol-2-yl-2-methyl-phenylamine
C14H12N2O (224.09495819999998)
1-(3-METHOXYBIPHENYL-4-YL)ETHANONE
C14H12N2O (224.09495819999998)
1,2,3,6-TETRAHYDROINDOLIZINO[6,7-B]INDOL-5-ONE
C14H12N2O (224.09495819999998)
(R)-3-AMINO-N-METHYL-4-(PHENYLTHIO)BUTANAMIDE
C11H16N2OS (224.09832859999997)
8-METHYL-2-(PYRIDIN-2-YL)IMIDAZO[1,2-A]PYRIDIN-3-AMINE
8-(Benzyloxy)imidazo[1,5-a]pyridine
C14H12N2O (224.09495819999998)
(3-HYDROXY-BENZYL)-CARBAMICACIDTERT-BUTYLESTER
C14H12N2O (224.09495819999998)
1-benzyl-3H-pyrrolo[2,3-b]pyridin-2-one
C14H12N2O (224.09495819999998)
4-METHYL-6-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]-PYRIDIN-3-AMINE
1H-2-Benzopyran,3,4-dihydro-3-methyl-3-phenyl-(9CI)
4-Methylthiophene-2-boronic acid, pinacol ester
C11H17BO2S (224.10422520000003)
6-BENZYL-6,7-DIHYDROPYRROLO[3,4-B]PYRIDIN-5-ONE
C14H12N2O (224.09495819999998)
5-(6-METHOXY-2-NAPHTHYL)-1H-PYRAZOLE
C14H12N2O (224.09495819999998)
2-amino-n-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
C11H16N2OS (224.09832859999997)
Phenol,2-(6-methyl-1H-benzimidazol-2-yl)-
C14H12N2O (224.09495819999998)
1H-Benzimidazole,2-(4-methoxyphenyl)-
C14H12N2O (224.09495819999998)
(S)-2-HYDROXY-3-(4-METHOXY-PHENYL)-PROPIONIC ACID ETHYL ESTER
tert-Butyl (5-(hydroxymethyl)pyridin-2-yl)carbamate
3H-Indazol-3-one,1,2-dihydro-2-(phenylmethyl)-
C14H12N2O (224.09495819999998)
tert-butyl N-(1-methyl-6-oxopyridin-3-yl)carbamate
[3-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methanol
C14H12N2O (224.09495819999998)
Urea, N-(2,4-dihydroxyphenyl)-N-(1,1-dimethylethyl)- (9CI)
1-Benzyl-1,2-dihydro-3H-indazol-3-one
C14H12N2O (224.09495819999998)
2-(4-Methoxy-phenyl)-imidazo[1,2-a]pyridine
C14H12N2O (224.09495819999998)
(4-(ISOPENTYLTHIO)PHENYL)BORONIC ACID
C11H17BO2S (224.10422520000003)
1-Benzyl-1,3-dihydro-2H-benzimidazole-2-one
C14H12N2O (224.09495819999998)
(5-Hydroxymethyl-pyridin-2-yl)-carbamic acid tert-butyl ester
methyl 3-(4-fluorophenyl)pyrazolidine-4-carboxylate
6-pyridin-3-yl-3,4-dihydro-1H-quinolin-2-one
C14H12N2O (224.09495819999998)
1-BENZYL-2-FURAN-2-YL-1H-IMIDAZOLE
C14H12N2O (224.09495819999998)
2-amino-2-(4-{[2-(methyloxy)ethyl]oxy}phenyl)acetamide
8-(Benzyloxy)imidazo[1,2-a]pyridine
C14H12N2O (224.09495819999998)
(S)-(-)-2-(4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)pyridine
C14H12N2O (224.09495819999998)
2-(2-N-butyl-4-hydroxy-6-methylpyrimidin-5-yl)acetic acid
1H-Imidazolium, 1,2-dimethyl-3-(2-propenyl)-, tetrafluoroborate(1-)
C8H13BF4N2 (224.11078559999999)
7H-Pyrrolo[2,3-d]pyrimidin-4-amine,7-(phenylmethyl)-
5-Amino-2-(4-aminophenyl)benzofuran
C14H12N2O (224.09495819999998)
1,3-dihydro-imidazol-2-one-5-cyclopentylethyl-4-carboxylic acid
(2-((Dimethylamino)methyl)-5-nitrophenyl)boronic acid
N-(3-CYANOPHENYL)-N-(4-METHOXYPHENYL)AMINE
C14H12N2O (224.09495819999998)
nifenalol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist
2-(1-NAPHTHYL)-4-(HYDROXYMETHYL)IMIDAZOLE
C14H12N2O (224.09495819999998)
4-Hydroxy-6-(2-oxoheptyl)pyran-2-one
A pyranone that is 2H-pyran-2-one in which the hydrogens at positions 4 and 6 are substituted by hydroxy and 2-oxoheptyl groups respectively.
3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide
3-Phenyl-N-pyridin-3-yl-acrylamide
C14H12N2O (224.09495819999998)
3-(4-Methoxyphenyl)imidazo[1,5-a]pyridine
C14H12N2O (224.09495819999998)
1H-indol-3-yl(pyridin-2-yl)methanol
C14H12N2O (224.09495819999998)
tert-butyl N-[(E)-1-(furan-2-yl)ethylideneamino]carbamate
(2S)-2,6-dimethylheptyl hydrogen sulfate
The (S)-enantiomer of 2,6-dimethylheptyl hydrogen sulfate.
4H-Pyrido[1,2-a]pyrimidine-3-carboxylic acid, 1,6,7,8,9,9a-hexahydro-4-oxo-, ethyl ester
Phosphonic acid, methyl-, 2-methylpropyl trimethylsilyl ester
Methyl 4-hydroxy-2-methoxy-3,5,6-trimethylbenzoate
3-Pyridinecarboxamide, 1,6-dihydro-1-methyl-6-oxo-N-(trimethylsilyl)-
Talbutal
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate
2,3-Dihydroxybutanedioic acid;propane-1,3-diamine
C7H16N2O6 (224.10083160000002)
7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one
2-Amino-5-(diaminomethylideneazaniumyl)-2-(difluoromethyl)pentanoate
Senkyunolide H
Senkyunolide H is a natural compound isolated from Ligusticum chuanxiong Hort[1]. Senkyunolide H is a natural compound isolated from Ligusticum chuanxiong Hort[1]. Senkyunolide I, isolated from Ligusticum chuanxiong Hort, is an anti-migraine compound. Senkyunolide I protects rat brain against focal cerebral ischemia-reperfusion injury by up-regulating p-Erk1/2, Nrf2/HO-1 and inhibiting caspase 3[1][2]. Senkyunolide I, isolated from Ligusticum chuanxiong Hort, is an anti-migraine compound. Senkyunolide I protects rat brain against focal cerebral ischemia-reperfusion injury by up-regulating p-Erk1/2, Nrf2/HO-1 and inhibiting caspase 3[1][2].
(5Z,9Z)-4-hydroxy-12-methyl-1-oxacyclododeca-5,9-diene-2,8-dione
(2S,3S,4R,5R)-2-(4-aminophenyl)-5-hydroxymethylpyrrolidine-3,4-diol
(2R)-2,6-dimethylheptyl hydrogen sulfate
The (R)-enantiomer of 2,6-dimethylheptyl hydrogen sulfate.
ethyl N-[1-(diethylamino)ethylidene]phosphoramidofluoridate
7-Methyloctyl hydrogen sulfate
An alkyl sulfate that is 7-methyloctyl ester of sulfuric acid.
2-(butylthio)-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
C11H16N2OS (224.09832859999997)
N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine
3-[(3aS,4S,7aS)-1,5-dioxo-octahydroinden-4-yl]propanoic acid
A dioxo monocarboxylic acid that consists of hydrindane bearing two oxo substituents at positions 1 and 5 and a 2-carboxyethyl substituent at position 4 (3aS,4S,7aS-diastereomer).
6-Methoxy-3-(3-methylbut-2-enyl)benzene-1,2,4-triol
7-Methoxy-2,2-dimethyl-3,4-dihydrochromene-4,5-diol
2-[2-(7H-purin-1-ium-6-ylamino)ethoxy]ethanol
C9H14N5O2+ (224.11474440000003)
2-[(E)-4-hydroxy-3-methylbut-2-enyl]-5-methoxybenzene-1,3-diol
2-[(3,3-Dimethyloxiran-2-yl)methyl]-5-methoxybenzene-1,3-diol
2-Isopropylbenzenethiol, TMS derivative
C12H20SSi (224.10549200000003)
4-Isopropylbenzenethiol, TMS derivative
C12H20SSi (224.10549200000003)
(3-Phenylthiopropyl)trimethylsilane
C12H20SSi (224.10549200000003)
2-Methoxy-3,7-bis(methoxymethyl)cyclohepta-2,4,6-trien-1-one
2-deuterio-2-phenyl-3,4-dihydro-1H-naphthalen-1-ol
PhIP
D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens
Tetramethyluric acid
An oxopurine that is uric acid in which the hydrogens at positions 1,3,7 and 9 are replaced by methyl groups. It is a purine alkaloid that is found in Chinese tea known as kucha (Camellia assamica var. kucha) and exhibits anti-inflammatory and analgesic properties.
4-(4,5-dimethyl-1,3-dioxolan-2-yl)-2-methoxyphenol
tert-butyl 4-hydroxy-3-methoxybenzoate
A benzoate ester that is tert-butyl benzoate that carries a methoxy group at position 3 and a hydroxy group at position 4 of the phenyl ring.
2,4,6-trihydroxyphenylhexan-1-one
A 2-acylphloroglucinol in which the acyl group is specified as hexanoyl. It is the intermediate biosynthetic precursor for differentiation-inducing factor 1 (DIF-1).
8a-hydroxy-8-methoxy-3,5-dimethyl-3,4-dihydro-1h-2-benzopyran-6-one
3-[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]-5-(hydroxymethyl)-3h-oxepin-2-one
3-ethoxy-1-(4-hydroxy-3-methoxyphenyl)propan-1-one
methyl 2-[(1r,2r)-3-methoxy-5-oxo-2-[(1z)-prop-1-en-1-yl]cyclopent-3-en-1-yl]acetate
6-[(2e)-4-hydroxypent-2-en-2-yl]-4-methoxy-3-methylpyran-2-one
4-methoxy-7-propyl-5h,7h,8h-pyrano[3,2-c]pyran-2-one
1-(4-hydroxy-1,3-dihydro-2-benzofuran-1-yl)butane-2,3-diol
methyl (3z,5e)-5-methoxy-2-methyl-7-oxocycloocta-3,5-diene-1-carboxylate
4-hydroxy-3-methyl-6-(3-methyl-2-oxopentyl)pyran-2-one
5-hydroxy-2-(3-hydroxy-3-methylbut-1-en-1-yl)-5-methylcyclohex-2-ene-1,4-dione
6-methoxy-3,7-dimethyl-3,4-dihydro-1h-2-benzopyran-1,8-diol
(7r,8r,8as)-7,8-dihydroxy-3,4,7-trimethyl-8,8a-dihydro-1h-isochromen-6-one
4-[2-(phenylmethylidene)hydrazin-1-yl]benzaldehyde
C14H12N2O (224.09495819999998)
methyl 2-{3-methoxy-5-oxo-2-[(1z)-prop-1-en-1-yl]cyclopent-3-en-1-yl}acetate
(3z,6s,7r)-3-butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one
(1s,3r)-6-methoxy-3,7-dimethyl-3,4-dihydro-1h-2-benzopyran-1,8-diol
6-hydroxy-5-(1-hydroxy-2-oxopropyl)-4-(prop-1-en-1-yl)cyclohex-2-en-1-one
1,2,4-trimethoxy-5-(E-3'-methyloxiranyl)benzene
{"Ingredient_id": "HBIN000669","Ingredient_name": "1,2,4-trimethoxy-5-(E-3'-methyloxiranyl)benzene","Alias": "NA","Ingredient_formula": "C12H16O4","Ingredient_Smile": "CC1C(O1)C2=CC(=C(C=C2OC)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34422","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-[(2e)-2-(phenylmethylidene)hydrazin-1-yl]benzaldehyde
C14H12N2O (224.09495819999998)
(6r,7r)-3-butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one
(2r,3s,4e)-5-[3-hydroxy-2-(hydroxymethyl)phenyl]pent-4-ene-2,3-diol
7,8-dihydroxy-3,4,7-trimethyl-8,8a-dihydro-1h-isochromen-6-one
n-(4-aminobutyl)-2,3-dihydroxybenzenecarboximidic acid
3-(4-hydroxy-3-methylbut-2-en-1-yl)-5-(hydroxymethyl)-3h-oxepin-2-one
6-(4-hydroxypent-2-en-2-yl)-4-methoxy-3-methylpyran-2-one
methyl (1s,2r,3z,5e)-5-methoxy-2-methyl-7-oxocycloocta-3,5-diene-1-carboxylate
(2r,3s)-1-[(1r)-4-hydroxy-1,3-dihydro-2-benzofuran-1-yl]butane-2,3-diol
(4s,9e,12r)-4-hydroxy-12-methyl-1-oxacyclododeca-5,9-diene-2,8-dione
2-[(3r,4r)-3,4-dihydroxypentyl]-6-hydroxybenzaldehyde
(3s,8as)-8a-hydroxy-8-methoxy-3,5-dimethyl-3,4-dihydro-1h-2-benzopyran-6-one
(4s)-4-[(2r)-2-methyl-5-oxooxolan-2-yl]cyclohex-1-ene-1-carboxylic acid
1-(2,4,6-trihydroxy-3,5-dimethylphenyl)butan-1-one
(1r,3s)-6-methoxy-3,7-dimethyl-3,4-dihydro-1h-2-benzopyran-1,8-diol
(3s,4r)-8-methoxy-3,5-dimethyl-3,4-dihydro-1h-2-benzopyran-4,6-diol
1-(4-hydroxy-3-methylbut-2-en-1-yl)-3-(hydroxymethyl)-6-oxabicyclo[3.2.0]hept-2-en-7-one
(7s)-4-methoxy-7-propyl-5h,7h,8h-pyrano[3,2-c]pyran-2-one
2-(dimethylamino)ethyl n-phenyl-1-sulfanylmethanimidate
C11H16N2OS (224.09832859999997)