Exact Mass: 372.1661
Exact Mass Matches: 372.1661
Found 500 metabolites which its exact mass value is equals to given mass value 372.1661
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Fargesone A
Fargesone A is a member of benzodioxoles. Fargesone A is a natural product found in Piper wightii, Piper hymenophyllum, and other organisms with data available.
Biocytin
Biocytin is a naturally occurring low molecular weight analog of biotin, and a primary source of this essential metabolite for mammals. Biotinidase acts as a hydrolase by cleaving biocytin and biotinyl-peptides, thereby liberating biotin for reutilization. Mammals cannot synthesize biotin and, therefore, derive the vitamin from dietary sources or from the endogenous turnover of the carboxylases. Free biotin can readily enter the biotin pool, whereas holocarboxylases or other biotin-containing proteins must first be degraded proteolytically to biocytin (biotinyl-e-lysine) or biotinyl-peptides. Biocytin is also an especially versatile marker for neuroanatomical investigations, shown that may have multiple applications, especially for labeling neurons. (PMID: 8930409, 1384763, 2479450) [HMDB] Biocytin is a naturally occurring low molecular weight analog of biotin, and a primary source of this essential metabolite for mammals. Biotinidase acts as a hydrolase by cleaving biocytin and biotinyl-peptides, thereby liberating biotin for reutilization. Mammals cannot synthesize biotin and, therefore, derive the vitamin from dietary sources or from the endogenous turnover of the carboxylases. Free biotin can readily enter the biotin pool, whereas holocarboxylases or other biotin-containing proteins must first be degraded proteolytically to biocytin (biotinyl-e-lysine) or biotinyl-peptides. Biocytin is also an especially versatile marker for neuroanatomical investigations, shown that may have multiple applications, especially for labeling neurons. (PMID:8930409, 1384763, 2479450).
(-)-Arctigenin
(-)-Arctigenin is found in burdock. (-)-Arctigenin is isolated from Cnicus benedictus, Forsythia viridissima, Arctium lappa, Ipomoea cairica and others (CCD).Arctigenin is a lignan found in certain plants of the Asteraceae , including the Greater burdock (Arctium lappa) and Saussurea heteromalla. It has shown antiviral and anticancer effects. It is the aglycone of arctiin. (Wikipedia (-)-Arctigenin is a lignan. Arctigenin is a natural product found in Centaurea cineraria, Forsythia suspensa, and other organisms with data available. See also: Arctium lappa Root (part of); Arctium lappa fruit (part of); Pumpkin Seed (part of) ... View More ... Isolated from Cnicus benedictus, Forsythia viridissima, Arctium lappa, Ipomoea cairica and others (CCD) Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3]. Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3].
Kadsurin A
Buthiobate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D007096 - Imidoesters
Acebutolol HCl
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Acebutolol hydrochloride is an orally active β1 adrenergic receptor (β1AR) antagonist. Acebutolol hydrochloride is used in the treatment of hypertension, angina pectoris and cardiac arrhythmias[1][2][3].
6,7-Dihydroxybergamottin
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors
Tetrahydrocurcumin
Tetrahydrocurcumin (THC), is a product of bacterial or intestinal metabolism of curcumin (via the bacterial enzyme NADPH-dependent curcumin reductase). Curcumin is a yellow, polyphenolic pigment, derived from the rhizomes of a plant (Curcuma longa Linn). It is the principal curcuminoid of the popular Indian spice turmeric, which is a member of the ginger family and is a natural antioxidant exhibiting a variety of pharmacological activities and therapeutic properties. It has long been used as a traditional medicine and as a preservative and coloring agent in foods. In E. coli curcumin is a substrate for the enzyme NADPH-dependent curcumin reductase which catalyzes the metal-independent reduction of curcumin to dihydrocurcumin (DHC) as an intermediate product, followed by further reduction to tetrahydrocurcumin (THC) as an end product. Tetrahydrocurcumin (THC) exhibits many of the same physiologic and pharmacological activities as curcumin and in some systems may exert greater antioxidant activity than curcumin (PMID: 16061427). Tetrahydrocurcumin is a beta-diketone that is curcumin in which both of the double bonds have been reduced to single bonds. It has a role as a metabolite. It is a beta-diketone, a polyphenol and a diarylheptanoid. It is functionally related to a curcumin. Tetrahydrocurcumin is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Tetrahydrocurcumin is a natural product found in Curcuma longa with data available. Tetrahydrocurcumin (THC), one of the major metabolites of curcumin, exhibits many of the same physiologic and pharmacological activities as curcumin and in some systems may exert greater antioxidant activity than curcumin (PMID: 16061427). Tetrahydrocurcumin is found in turmeric. A beta-diketone that is curcumin in which both of the double bonds have been reduced to single bonds. Tetrahydrocurcumin is a Curcuminoid found in turmeric (Curcuma longa) that is produced by the reduction of Curcumin. Tetrahydrocurcumin inhibit CYP2C9 and CYP3A4. Tetrahydrocurcumin is a Curcuminoid found in turmeric (Curcuma longa) that is produced by the reduction of Curcumin. Tetrahydrocurcumin inhibit CYP2C9 and CYP3A4.
Hydroxymyricanone
Hydroxymyricanone is found in herbs and spices. Hydroxymyricanone is a constituent of Myrica gale (bog myrtle). Constituent of Myrica gale (bog myrtle). Hydroxymyricanone is found in herbs and spices. Hydroxymyricanone is a member of biphenyls.
Deacetyldiltiazem
Deacetyldiltiazem is a metabolite product of the drug Diltiazem (a coronary vasodilator), and is present in the plasma of individuals taking that medication. (PMID 2328299). The action mechanisms involved in the effect of Deacetyldiltiazem on blood rheological (erythrocyte deformation) properties appeared to be similar to Diltiazem, but different from other metabolites of this drug. (PMID 3411434). Deacetyldiltiazem is a metabolite product of the drug Diltiazem (a coronary vasodilator), and is present in the plasma of individuals taking that medication. (PMID 2328299)
6',7'-Dihydroxybergamottin
Isolated from Citrus macroptera whole fruits, a non-commercial species of the South Pacific. 4-[(6,7-Dihydroxy-3,7-dimethyl-2-octenyl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one is found in citrus. 6,7-Dihydroxybergamottin is found in citrus. 6,7-Dihydroxybergamottin is isolated from Citrus macroptera whole fruits, a non-commercial sp. of the South Pacific. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors
(8R,8'R,9S)-9-Hydroxy-3,4-dimethoxy-3',4'-methylenoxy-9,9'-epoxylignan
(8R,8R,9S)-9-Hydroxy-3,4-dimethoxy-3,4-methylenoxy-9,9-epoxylignan is a constituent of Piper chaba (Javanese long pepper) Constituent of Piper chaba (Javanese long pepper)
Licoriphenone
Constituent of licorice (Glycyrrhiza species). Licoriphenone is found in alcoholic beverages and herbs and spices. Licoriphenone is found in alcoholic beverages. Licoriphenone is a constituent of licorice (Glycyrrhiza sp.)
9-Hydroxy-3',4'-dimethoxy-3,4-methylenedioxy-9,9'-epoxylignan
9-Hydroxy-3,4-dimethoxy-3,4-methylenedioxy-9,9-epoxylignan is found in herbs and spices. 9-Hydroxy-3,4-dimethoxy-3,4-methylenedioxy-9,9-epoxylignan is a constituent of Piper nigrum (pepper). Constituent of Piper nigrum (pepper). 9-Hydroxy-3,4-dimethoxy-3,4-methylenedioxy-9,9-epoxylignan is found in herbs and spices.
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-methylenedioxyphenyl)-1-propanol
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-methylenedioxyphenyl)-1-propanol is found in herbs and spices. 2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-methylenedioxyphenyl)-1-propanol is a constituent of Myristica fragrans (nutmeg)
Tetrahydro-2-(bis(2-chloroethyl)amino)-3-heptyl-6-methyl-2H-1,3,2-oxazaphosphorine 2-oxide
Diamfenetide
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Medroxalol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
Pyroglutamyl-phenylalanyl-prolinamide
Sylvatesmin
Sylvatesmin is a natural product found in Forsythia suspensa, Lindera praecox, and other organisms with data available. Phillygenin (Phillygenol) is an active ingredient from Forsythia with many medicinal properties, such as antioxidant, reducing blood lipid, inhibition of low density lipoprotein oxidation. Phillygenin (Phillygenol) is an active ingredient from Forsythia with many medicinal properties, such as antioxidant, reducing blood lipid, inhibition of low density lipoprotein oxidation.
Phillygenin
Phillygenin (Phillygenol) is an active ingredient from Forsythia with many medicinal properties, such as antioxidant, reducing blood lipid, inhibition of low density lipoprotein oxidation. Phillygenin (Phillygenol) is an active ingredient from Forsythia with many medicinal properties, such as antioxidant, reducing blood lipid, inhibition of low density lipoprotein oxidation.
[3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid
3a-Allyl-2-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-3-methyl-3,3a,4,5-tetrahydro-1-benzofuran-6(2H)-one #
MEDROXALOL
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
PENICILLIDE
2,4-Di-Me ether,1-O-beta-D-glucopyranoside-6-(1-Methylpropyl)-1,2,4-benzenetriol
(7S,8R,8R)-3,4-dimethoxy-3,4-methylenedioxy-7,9-epoxylignan-9-ol
(E)-3-[(2S,3R)-2,3-dihydro-3-hydroxymethyl-7-methoxy-2-(3,4-dimethoxyphenyl)-1-benzo[b]furan-5-yl]-2-propen-1-ol|hierochin B
methyl rel-(1R,4R,4aR,7R,8S,8aS)-8-[(E)-2-(3-furyl)vinyl]-1,4,4a,5,6,7,8,8a-octahydro-4-hydroxy-4a,8-dimethyl-9-oxo-1,4-(epoxymethano)naphthalene-7-carboxylate|tinosagittone A
2,6-dimethyl-3-hydroxymethyl-5-oxo-1,6-heptadiene-9-O-(6-acetyl-beta-D-glucopyranoside)
(2E)-1-[2,4-dihydroxy-3-(3-hydroxy-3-methylbutyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)-2-propen-1-one|3-(3-methyl-3-hydroxybutyl)-2,4,4-trihydroxy-6-methoxychalcone|xanthohumol H
4-hydroxy-2-(3-hydroxy-3-methylbutyl)-5-methylphenyl beta-D-glucopyranoside|4-Hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenyl ??-D-glucopyranoside
2,5-Dimethoxy-2-(2-propenyl)-4-[2-hydroxy-1-methyl-2-(1,3-benzodioxol-5-yl)ethyl]-3,5-cyclohexadien-1-one
(3S)-3-hydroxysedanolide beta-D-glucopyranoside|celephthalide C
(7R,8R,3R)-7-hydroxy-3,4-dimethoxy-3,4-methylenedioxy-6-oxo-Delta-1,4,8-8.3-lignan|2-Allyl-4-[2-hydroxy-1-methyl-2-(3,4-metylenedioxyphenyl)ethyl]4,5-dimethoxy-2,5-cyclohexadien-1-one
5,5,6-Trimethyl-6-(1,2,3-triacetoxy-butyl)-tetrahydro-pyran-2-on|5,5,6-trimethyl-6-(1,2,3-triacetoxy-butyl)-tetrahydro-pyran-2-one
2-methylbut-(2Z)-enoic acid (3R)-5-methoxy-3,4-dihydro-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b]dipyran-3-yl ester
5-(6-hydroxyhexyl)benzene-1,3-diol 1-O-beta-D-glucopyranoside|5-(6-hydroxyhexyl)resorcinol 1-O-beta-D-glucopyranoside|grevilloside H
(E)-6-(2-hydroxy-6-(hydroxymethyl)-4-methylphenoxy)-2-methoxy-3-(3-methylbut-1-en-1-yl)benzoic acid|penikellide A
15-dehydro-17-hydroxycyrtophyllone A|[12,16-epoxy-6-methoxy-11,14,17-trihydroxy-17(15?16)-abeo-5,8,11,13,15-abietapentaen-7-one]
(+)-3-O-demethyleusiderin C.|(7S,8R)-Delta8-3-hydroxy-4,5,5-trimethoxy-7.O.3,8.O.4-neolignan
(10R,16S)-12,16-epoxy-11,14-dihydroxy-6-methoxy-17(15?16)-abeo-abieta-5,8,11,13-tetraene-3,7-dione
(+)-4-O-demethyleusiderin C|(7S,8R)-Delta8-4-hydroxy-3,5,5-trimethoxy-7.O.3,8.O.4-neolignan
4-(4-(3,5-dimethoxyphenyl)hexahydrofuro[3,4-c]furan-1-yl)-2-methoxyphenol|bombasinol A
(7R,8R,3S,4R,5R)-Delta8-4-hydroxy-5,5-dimethoxy-3,4-methylenedioxy-2,3,4,5-tetrahydro-2-oxo-7.3,8.5-neolignan|cinerin B
Delta8-3,4,5-trimethoxy-3,6-dihydro-3,4-methylenedioxy-6-oxo-8,3-neolignan
1-Aldehyde,8-O-(2-acetyl-beta-D-glucopyranoside)-(E)-2-Methyl-6-methylene-2-octene-1,8-diol|7-Formyl-3-methylene-6E-octenol-O-beta-D-(2-O-acetylglucopyranoside)|7-Formyl-3-methylene-6E-octenol-O-beta-D-<2-O-acetylglucopyranoside>
6,7-Dihydroxy-8-geranylpsoralen|9-[(6,7-dihydroxy-3,7-dimethyl-2-octenyl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one
(1S, 3S, 5R, 6R, 7R, 8S)-3-acetoxy-8-methacrylyloxyguai-4(15), 10(14), 11(13)-trien-6,12-olide
8beta-((2-R*,3R*)-2-Methyl-2,3-epoxybutyryloxy)dehydroleucodin|8beta-<(2-R*,3R*)-2-Methyl-2,3-epoxybutyryloxy>dehydroleucodin
DGR7D6J5TR
4-[(3S,3aR,6S,6aR)-6-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol
Arctigenin
Annotation level-1 Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3]. Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3].
C20H24N2O5_3-Pyridinecarboxylic acid, 1,4-dihydro-6-(hydroxyphenylmethyl)-1-[2-[(3-methyl-1-oxobutyl)amino]ethyl]-4-oxo
C21H24O6_5H,7H-Dibenzo[b,g][1,5]dioxocin-5-one, 11-hydroxy-3-(1-hydroxy-3-methylbutyl)-4-methoxy-9-methyl
C22H20N4O2_3,6-Bis(1H-indol-3-ylmethyl)-2,5-piperazinedione
Biocytin
A monocarboxylic acid amide that results from the formal condensation of the carboxylic acid group of biotin with the N(6)-amino group of L-lysine.
6-hydroxy-2-(1-hydroxy-3-methylbutyl)-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one
Fellutanine A
Origin: Microbe; SubCategory_DNP: Peptides, Cyclic peptides, Piperazines
6-hydroxy-2-(1-hydroxy-3-methylbutyl)-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one_major
Ala Ala Asp Pro
Ala Ala Pro Asp
Ala Asp Ala Pro
Ala Asp Pro Ala
Ala Glu Gly Pro
Ala Glu Pro Gly
Ala Gly Glu Pro
Ala Gly Pro Glu
Ala Pro Ala Asp
Ala Pro Asp Ala
Ala Pro Glu Gly
Ala Pro Gly Glu
Asp Ala Ala Pro
Asp Ala Pro Ala
Asp Pro Ala Ala
Glu Ala Gly Pro
Glu Ala Pro Gly
Glu Gly Ala Pro
Glu Gly Pro Ala
Glu Pro Ala Gly
Glu Pro Gly Ala
Gly Ala Glu Pro
Gly Ala Pro Glu
Gly Glu Ala Pro
Gly Glu Pro Ala
Gly Pro Ala Glu
Gly Pro Glu Ala
Pro Ala Ala Asp
Pro Ala Asp Ala
Pro Ala Glu Gly
Pro Ala Gly Glu
Pro Asp Ala Ala
Pro Glu Ala Gly
Pro Glu Gly Ala
Pro Gly Ala Glu
Pro Gly Glu Ala
6,7-dihydroxy Bergamottin
Tetrahydrocurcumin
Tetrahydrocurcumin is a Curcuminoid found in turmeric (Curcuma longa) that is produced by the reduction of Curcumin. Tetrahydrocurcumin inhibit CYP2C9 and CYP3A4. Tetrahydrocurcumin is a Curcuminoid found in turmeric (Curcuma longa) that is produced by the reduction of Curcumin. Tetrahydrocurcumin inhibit CYP2C9 and CYP3A4.
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-methylenedioxyphenyl)-1-propanol
3,4-Dimethoxy-3,4-desmethylenecubebin
3',4'-Dimethoxy-3',4'-desmethylenecubebin
Licoriphenone
Hydroxymyricanone
(3-N-BOC-AMINO-PYRROLIDIN-1-YL)-THIOPHEN-3-YL-ACETICACID
1-PYRROLIDIN-2-(2-CHLOROPHENYL)-2-(N-CBZ-N-METHYL)AMINO-ETHANE
1-PYRROLIDIN-2-(3-CHLOROPHENYL)-2-(N-CBZ-N-METHYL)AMINO-ETHANE
N-[(1R)-3-(Dimethylamino)-3-oxo-1-[(phenylthio)Methyl]propyl]carbamic Acid Phenylmethyl Ester
benzoic acid,2,2-dimethylpropane-1,3-diol,hexanedioic acid
3H-Indolium,2-[2-[(2,4-dimethoxyphenyl)amino]ethenyl]-1,3,3-trimethyl-, chloride (1:1)
2,2-Spirobi[2H-1-benzopyran]-6,6,7,7-tetrol,3,3,4,4-tetrahydro-4,4,4,4-tetramethyl-
Cyclo(-Trp-Trp)
Cyclo(L-Trp-L-Trp) is an antibiotic, and shows antimicrobial activity. Cyclo(L-Trp-L-Trp) can inhibit A. baumannii, as well as Candida albicans, Bacillus subtilis, Micrococcus luteus, Saccharomyces cerevisiae, Aspergillus niger, Staphylococcus aureus. Cyclo(L-Trp-L-Trp) can be used in microbial infection research[1].
2-AMINO-6-(MORPHOLINOMETHYL)-4-PHENYL-5H-INDENO[1,2-D]PYRIMIDIN-5-ONE
3,3-dimethyl-13-phenyl-4,13-dihydro-2H-indazolo[1,2-b]phthalazine-1,6,11-trione
4-(4-ETHOXYPHENOXYCARBONYL)PHENYL PENTYL CARBONATE
(9H-FLUOREN-9-YL)METHYL ((1R,4R)-4-AMINOCYCLOHEXYL)CARBAMATE HYDROCHLORIDE
ly 272015 hydrochloride
LY-272015 hydrochloride is an orally active, specific 5-HT2B receptor antagonist. LY-272015 hydrochloride completely inhibits the phosphorylation of ERK2 induced by 5-HT or BW723C86. LY-272015 hydrochloride is antihypertensive in Deoxycorticosterone Acetate (DOCA)-salt-hypertensive rats[1][2].
N,N-(Methylene-p-phenylene)-bis-[N-(2-hydroxyethyl)]urea
N-[(1R)-1-Hydroperoxy-3-methylbutyl]-Nα-(2-pyrazinylcarbonyl)-L-phenylalaninamide
N-[(1S)-1-Hydroperoxy-3-methylbutyl]-Nα-(2-pyrazinylcarbonyl)-L-phenylalaninamide
Dihydroxybergamottin
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors
(9H-Fluoren-9-yl)methyl 4-(aminomethyl)piperidine-1-carboxylate hydrochloride
N-Acetyl-leucyl-phenylalanyl trifluoromethyl ketone
1,7-Bis(3-methoxy-4-hydroxyphenyl)-5-hydroxy-4-hepten-3-one
(R)-2-Amino-3-((3-octylphenyl)amino)-3-oxopropyl dihydrogen phosphate
D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents > D000081243 - Sphingosine 1 Phosphate Receptor Modulators
2-[[1-Oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]-5-isoquinolinyl]oxy]acetic acid ethyl ester
2-ethoxy-N-(3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl)benzamide
5-(2-Aminoethyl)-3-{5-[amino(iminio)methyl]-1H-benzimidazol-2-YL}-1,1-biphenyl-2-olate
Arctigenen
Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3]. Arctigenin ((-)-Arctigenin), a biologically active lignan, can be used as an antitumor agent. Arctigenin exhibits potent antioxidant, anti-inflammatory and antiviral (influenza A virus) activities. Arctigenin can be used for the research of metabolic disorders, and central nervous system dysfunctions[1][2][3].
Biocytin zwitterion
An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of biocytin; major species at pH 7.3.
7-O-acetylsalutaridinol(1+)
The conjugate acid of 7-O-acetylsalutaridinol arising from protonation of the tertiary amino function.
methyl-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]azanium
2-(2-methylphenoxy)-N-[2-(4-methylphenyl)-2H-benzotriazol-5-yl]acetamide
4-[[(3,4-Dimethoxyanilino)-oxomethyl]amino]benzoic acid butyl ester
N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-3,4-dimethylbenzamide
4-[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-N-(5-methyl-3-isoxazolyl)-4-oxobutanamide
(-)-3,4-Dimethoxy-3,4-desmethylenedioxycubebin
A lignan that consists of tetrahydrofuran-2-ol substituted by a 1,3-benzodioxol-5-ylmethyl group at positions 3 and a 3,4-dimethoxybenzyl group at position 4 (the 3R,4R stereoisomer). It is isolated from the leaves of Piper nigrum and exhibits histamine release inhibitory activity.
3-Methyl-7-pentyl-8-(2-phenylethylthio)purine-2,6-dione
N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-2-pyrazinecarboxamide
2-[2-[4-(4-Fluorophenyl)-1-piperazinyl]-2-oxoethoxy]benzoic acid methyl ester
17beta-(Acetylthio)estra-1,3,5(10)-trien-3-ol acetate
2-(1-oxopropylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
N-[[(2R,3S,4R)-4-(hydroxymethyl)-3-[4-[(E)-prop-1-enyl]phenyl]azetidin-2-yl]methyl]benzenesulfonamide
5,7-dihydroxy-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-2,3,4a,8a-tetrahydro-4H-chromen-4-one
(1S,5R)-7-[4-[(Z)-prop-1-enyl]phenyl]-6-[[2-(trifluoromethyl)phenyl]methyl]-3,6-diazabicyclo[3.1.1]heptane
(4Z)-2-Ethyl-4-[(4-ethylphenyl)methylidene]-1,3-dihydrobenzo[b][1,6]naphthyridine-10-carboxylic acid
4-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(3-methoxyphenyl)heptane-3,5-dione
[3-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] octanoate
Acetic acid, 2-trimethylsiloxy-2,2-diphenyl-, trimethylsilyl ester
(3S)-3-(Tert-butyldimethylsilyloxy)-5-tosylpentanol
(3S)-3,6-bis(1H-indol-3-ylmethyl)piperazine-2,5-dione
(8R,8R,9S)-9-Hydroxy-3,4-dimethoxy-3,4-methylenoxy-9,9-epoxylignan
(R)-(+)-6,7-dihydroxybergamottin
A natural product found in Citrus hystrix.
AS-186a
A dibenzodioxocine that is 5H,7H-dibenzo[b,g][1,5]dioxocin-5-one substituted by a hydroxy group at position 11, a (1S)-1-hydroxy-3-methylbutyl group at position 3 and a methoxy and a methyl group at positions 4 and 9 respectively. It is isolated from the culture broth of Penicillium asperosporum and acts as an acyl-CoA:cholesterol acyltransferase inhibitor.
fellutanine
A member of the class of 2,5-diketopiperazines that is piperazine-2,5-dione substituted by 1H-indol-3-ylmethyl groups at positions 3 and 6 respectively. Isolated from Penicillium species, it exhibits antibacterial activity.
CBL0137 (hydrochloride)
CBL0137 hydrochloride is an inhibitor of the histone chaperone, FACT. CBL0137 hydrochloride can also activate p53 and inhibits NF-κB with EC50s of 0.37 and 0.47 μM, respectively.
N-[(4-Aminophenyl)methyl]adenosine
N-[(4-Aminophenyl)methyl]adenosine is a adenosine receptor inhibitor, with Ki of 29 nM for Rat ecto-5′-Nucleotidase. IC50 value: 29.0 ± 1.7 nM (Ki) Target: Adenosine Receptor N-[(4-Aminophenyl)methyl]adenosine is a adenosine receptor inhibitor, with Ki of 29 nM for Rat ecto-5′-Nucleotidase. IC50 value: 29.0 ± 1.7 nM (Ki) Target: Adenosine Receptor
15-(butoxymethyl)-6,14-dihydroxy-4,7,12-trimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-5-methyl-4-oxo-2-(prop-1-en-2-yl)hex-5-en-1-yl]oxy}oxan-2-yl]methyl acetate
2-{4-methoxy-7-methyl-5-oxo-2h,3h-furo[3,2-g]chromen-2-yl}propan-2-yl 3-methylbut-2-enoate
5-methoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)-3-methyl-3a-(prop-2-en-1-yl)-2,3,4,5-tetrahydro-1-benzofuran-6-one
2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(3,4-dimethoxyphenyl)methyl]butane-1,4-diol
4-{[(2e,6s)-6,7-dihydroxy-3,7-dimethyloct-2-en-1-yl]oxy}furo[3,2-g]chromen-7-one
(2r,3s,4s)-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-2h-1-benzopyran-3,4,7-triol
(2r,3r,4r)-4-(2h-1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-ol
3-[3-hydroxy-1-methoxy-1-(2-methylpropyl)-6-oxo-4h-pyrazino[2,1-b]quinazolin-4-yl]propanimidic acid
5-(2,5-dihydroxyphenyl)-3-{3-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]prop-2-en-1-ylidene}furan-2-one
(1s)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-en-1-yl (2r)-2-methylbutanoate
8-ethyl-5-(4-hydroxy-5,6-dimethyl-2-oxopyran-3-yl)-2,3,8-trimethyl-5,6-dihydrochromene-4,7-dione
16-hydroxy-6-(1-hydroxy-3-methylbutyl)-7-methoxy-14-methyl-2,10-dioxatricyclo[10.4.0.0³,⁸]hexadeca-1(16),3(8),4,6,12,14-hexaen-9-one
(1s,5s,6r,7s,8r)-7-(2h-1,3-benzodioxol-5-yl)-8-hydroxy-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-one
8-hydroxy-5-methoxy-7-(7-methoxy-2h-1,3-benzodioxol-5-yl)-6-methyl-3-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-one
2-(2h-1,3-benzodioxol-5-yl)-3a,7a-dimethoxy-3-methyl-5-(prop-2-en-1-yl)-3,7-dihydro-2h-1-benzofuran-6-one
6-(2h-1,3-benzodioxol-5-yl)-4-hydroxy-3,5-dimethoxy-7-methyl-1-(prop-2-en-1-yl)bicyclo[3.2.1]oct-2-en-8-one
(1r,5s,6s,7r,8s)-7-(2h-1,3-benzodioxol-5-yl)-8-hydroxy-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-one
2-[1-(3,4-dimethoxyphenyl)-2-methyl-3-oxobutyl]-4-hydroxy-5-methoxybenzaldehyde
4-{[(6r)-6,7-dihydroxy-3,7-dimethyloct-2-en-1-yl]oxy}furo[3,2-g]chromen-7-one
(3ar,4s,6ar,8s,9ar,9br)-8-(acetyloxy)-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
(12r)-12,18-dihydroxy-4,5-dimethoxytricyclo[13.3.1.0²,⁷]nonadeca-1(19),2(7),4,15,17-pentaene-3,6-dione
methyl 4-methyl-8-oxo-12-(prop-1-en-2-yl)-3,7,17-trioxatetracyclo[12.2.1.1⁶,⁹.0²,⁴]octadeca-1(16),9(18),14-triene-15-carboxylate
10-butanoyl-5-hydroxy-4-(1-hydroxypropyl)-8,8-dimethylpyrano[3,2-g]chromen-2-one
(2s)-1-(3,4-dimethoxyphenyl)-3-hydroxy-2-[2-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]propan-1-one
(1r,1's,6r)-1',4',6-trihydroxy-7'-methoxy-6'-methyl-3-(3-methylbut-2-en-1-yl)-1'h-spiro[cyclohexane-1,2'-inden]-3-ene-2,3'-dione
methyl (2s,4r,6s,12r)-4-methyl-8-oxo-12-(prop-1-en-2-yl)-3,7,17-trioxatetracyclo[12.2.1.1⁶,⁹.0²,⁴]octadeca-1(16),9(18),14-triene-15-carboxylate
(1r,5s,6r,7r,8r)-8-hydroxy-5-methoxy-7-(7-methoxy-2h-1,3-benzodioxol-5-yl)-6-methyl-3-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-en-2-one
6-[2-hydroxy-6-(hydroxymethyl)-4-methylphenoxy]-2-methoxy-3-[(1e)-3-methylbut-1-en-1-yl]benzoic acid
n-{6-[hydroxy(phenyl)methyl]-1-(2-hydroxyethyl)-4-oxopyridine-3-carbonyl}-3-methylbutanimidic acid
(3s,4r)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
4-[(1s,3ar,4s,6ar)-4-(3,4-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2-methoxyphenol
3,6-bis(1h-indol-3-ylmethyl)-3,6-dihydropyrazine-2,5-diol
2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-2h-1-benzopyran-3,4,7-triol
4-(2,6,6- trimethyl-1- cyclohexen-1- yl)-3- buten-2- on
{"Ingredient_id": "HBIN009861","Ingredient_name": "4-(2,6,6- trimethyl-1- cyclohexen-1- yl)-3- buten-2- on","Alias": "NA","Ingredient_formula": "C19H24N4O4","Ingredient_Smile": "CC1=CCCC(C1C=CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42888","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenylβ-d-glucopyranoside
{"Ingredient_id": "HBIN010435","Ingredient_name": "4-hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenyl\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C18H28O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10199","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}