Exact Mass: 406.1053
Exact Mass Matches: 406.1053
Found 500 metabolites which its exact mass value is equals to given mass value 406.1053,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Lancerin
Lancerin is a C-glycosyl compound that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, and 7 and a 1,5-anhydro-D-glucitol moiety at position 1. It has a role as a plant metabolite. It is a member of xanthones, a C-glycosyl compound and a polyphenol. Lancerin is a natural product found in Maclura cochinchinensis, Polygala tenuifolia, and other organisms with data available. A C-glycosyl compound that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, and 7 and a 1,5-anhydro-D-glucitol moiety at position 1. Lancerin, isolated from the root bark of Cudraniu cochinchinensis, possesses anti-lipid peroxidation[1]. Lancerin, isolated from the root bark of Cudraniu cochinchinensis, possesses anti-lipid peroxidation[1].
Astringin
Trans-astringin is a stilbenoid that is piceatannol substituted at position 3 by a beta-D-glucosyl residue. It has a role as a metabolite, an antioxidant and an antineoplastic agent. It is a polyphenol, a stilbenoid, a beta-D-glucoside and a monosaccharide derivative. It is functionally related to a piceatannol. Astringin is a natural product found in Fagopyrum megacarpum, Vitis vinifera, and other organisms with data available. Astringin is a metabolite found in or produced by Saccharomyces cerevisiae. A stilbenoid that is piceatannol substituted at position 3 by a beta-D-glucosyl residue. Acquisition and generation of the data is financially supported in part by CREST/JST. Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1]. Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1].
Rotenonone
2-(4-Chloro-3,5-dimethylphenoxy)-N-(2-phenyl-2H-benzotriazol-5-yl)-acetamide
Asperlicin C
A member of the class of asperlicins in which the core 6,7-dihydroquinazolino[3,2-a][1,4]benzodiazepine-5,13-dione skeleton is substituted at the 7 pro-S position by an indol-3-ylmethyl group. It is a cholecystokinin antagonist.
Piceatannol 4'-glucoside
Piceatannol 4-glucoside is found in green vegetables. Piceatannol 4-glucoside is isolated from Chinese rhubarb (Rheum sp.). Isolated from Chinese rhubarb (Rheum species). Piceatannol 4-glucoside is found in green vegetables.
Naproxen O-glucuronide
Naproxen O-glucuronide is a metabolite of naproxen. Naproxen sodium is a nonsteroidal anti-inflammatory drug (NSAID). Naproxen and naproxen sodium are marketed under various trade names, including: Aleve, Anaprox, Antalgin, Feminax Ultra, Flanax, Inza, Midol Extended Relief, Nalgesin, Naposin, Naprelan, Naprogesic, Naprosyn, Narocin, Proxen, Synflex and Xenobid. Naproxen was originally marketed as the prescription drug Naprosyn by Syntex in 1976, and naproxen sodium was first marketed under the trade name Anaprox in 1980. (Wikipedia)
Afzelechin 7-apioside
Afzelechin 7-apioside is a constituent of rhizomes of Polypodium glycyrrhiza (licorice fern)
(R)-Apiumetin glucoside
(R)-Apiumetin glucoside is found in green vegetables. (R)-Apiumetin glucoside is a constituent of Apium graveolens. Constituent of Apium graveolens. (R)-Apiumetin glucoside is found in wild celery and green vegetables.
omega-Salicoyisalicin
omega-Salicoyisalicin is isolated from the leaves of Populus balsamifera (balsam poplar
2-{4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-3-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Benzyl 2,6-dihydroxybenzoate 2-glucoside
Benzyl 2,6-dihydroxybenzoate 2-glucoside is found in fruits. Benzyl 2,6-dihydroxybenzoate 2-glucoside is a constituent of Sambucus nigra (elderberry). Constituent of Sambucus nigra (elderberry). Benzyl 2,6-dihydroxybenzoate 2-glucoside is found in fruits.
7-Chloro-3,4',5,6,8-pentamethoxyflavone
7-Chloro-3,4,5,6,8-pentamethoxyflavone is found in citrus. 7-Chloro-3,4,5,6,8-pentamethoxyflavone is a constituent of a Citrus sp. (Dancy tangerine). Constituent of a Citrus species (Dancy tangerine). 7-Chloro-3,4,5,6,8-pentamethoxyflavone is found in citrus.
(E)-Oxyresveratrol 3'-O-b-D-glucoside
(E)-Oxyresveratrol 3-O-b-D-glucoside is found in fruits. (E)-Oxyresveratrol 3-O-b-D-glucoside is isolated from Morus alba (white mulberry). Isolated from Morus alba (white mulberry). (E)-Oxyresveratrol 3-O-b-D-glucoside is found in fruits.
Flacourtin
Isolated from the bark of an Indian medicinal plant, Flacourtia indica. Flacourtin is found in herbs and spices and fruits. Flacourtin is found in fruits. Flacourtin is isolated from the bark of an Indian medicinal plant, Flacourtia indica.
Edulisin VI
Edulisin VI is found in green vegetables. Edulisin VI is a constituent of the fruit of Angelica edulis. Constituent of the fruit of Angelica edulis. Edulisin VI is found in green vegetables.
Dihydroresveratrol 3-glucuronide
Dihydroresveratrol 4'-glucuronide
(2S,3R,4S,5S,6R)-2-[2,4-Dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
4OH-Stil-2-O-glu
Bicyclomycin benzoate
Benzenesulfonamide, N-(((1,1-dimethylethyl)amino)carbonyl)-2-((4-methylphenyl)amino)-5-nitro-
Carbonyloxycamptothecin
3-[[(2S)-3-(4-Phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoic acid
ginkgolide K
Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1]. Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1].
Palomid 529
Palomid 529 is a potent inhibitor of mTORC1 and mTORC2 complexes. Palomid 529 is a potent inhibitor of mTORC1 and mTORC2 complexes.
3-Carboxy-11-(2,4-dichlorophenyl)-3,5-dihydroxyundecanoic acid
Tasquinimod
C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor
1-(2,3-Dihydroxyphenyl)-2-phenyl-2-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethanone
Astringin
Astringin is a member of the class of compounds known as stilbene glycosides. Stilbene glycosides are compounds structurally characterized by the presence of a carbohydrate moiety glycosidically linked to the stilbene skeleton. Astringin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Astringin can be found in grape wine, which makes astringin a potential biomarker for the consumption of this food product. Astringin is a stilbenoid, the 3-beta-D-glucoside of piceatannol. It can be found in the bark of Picea sitchensis or Picea abies (Norway spruce) . Astringin is a member of the class of compounds known as stilbene glycosides. Stilbene glycosides are compounds structurally characterized by the presence of a carbohydrate moiety glycosidically linked to the stilbene skeleton. Astringin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Astringin can be found in grape wine, which makes astringin a potential biomarker for the consumption of this food product. Astringin is a stilbenoid, the 3-β-D-glucoside of piceatannol. It can be found in the bark of Picea sitchensis or Picea abies (Norway spruce) . Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1]. Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1].
THSG cpd
(E)-2,3,5,4-tetrahydroxystilbene-2-O-beta-D-glucoside is a stilbenoid that is trans-stilbene which has been substituted by hydroxy groups at positions 2, 3, 5, and 4, and in which the hydroxy group at positon 2 has then been converted to the corresponding the beta-D-glucoside. It has a role as an antioxidant, a cyclooxygenase 2 inhibitor, an anti-inflammatory agent, a cardioprotective agent, a platelet aggregation inhibitor and an apoptosis inhibitor. It is a stilbenoid, a beta-D-glucoside and a member of resorcinols. (2S,3R,4S,5S,6R)-2-[2,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol is a natural product found in Euphorbia marschalliana, Hopea reticulata, and other organisms with data available. See also: Reynoutria multiflora root (part of). 2,3,4',5-tetrahydroxystilbene 2-OD-glucoside is isolated from the roots of Polygonaceae species and inhibits the formation of 5-HETE, HHT and thromboxane B2. 2,3,5,4'-Tetrahydroxystilbene 2-O-β-D-glucoside isolats from the roots of Polygonaceae species, inhibits the formation of 5-HETE, HHT and thromboxane B2. 2,3,5,4'-Tetrahydroxystilbene 2-O-β-D-glucoside has hypotensive, anti-ageing, anti-inflammatory, hypolipidemic, cardioprotective, and neuroprotective actions[1][2]. 2,3,4',5-tetrahydroxystilbene 2-OD-glucoside is isolated from the roots of Polygonaceae species and inhibits the formation of 5-HETE, HHT and thromboxane B2.
Ginkgolide
Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1]. Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1].
2,3,5,4-Tetrahydroxy stilbene 2-Ο-β-D-glucoside
2,3,4',5-tetrahydroxystilbene 2-OD-glucoside is isolated from the roots of Polygonaceae species and inhibits the formation of 5-HETE, HHT and thromboxane B2. 2,3,5,4'-Tetrahydroxystilbene 2-O-β-D-glucoside isolats from the roots of Polygonaceae species, inhibits the formation of 5-HETE, HHT and thromboxane B2. 2,3,5,4'-Tetrahydroxystilbene 2-O-β-D-glucoside has hypotensive, anti-ageing, anti-inflammatory, hypolipidemic, cardioprotective, and neuroprotective actions[1][2]. 2,3,4',5-tetrahydroxystilbene 2-OD-glucoside is isolated from the roots of Polygonaceae species and inhibits the formation of 5-HETE, HHT and thromboxane B2.
Neolancerin
Neolancerin is a natural product found in Hypericum sampsonii and Gentiana thunbergii with data available. Neolancerin is a natural product with weak cytotoxic activity against HL-60 cells[1].
O1-[3-(Trifluoromethyl)benzoyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanehydroximamide
1-[3-(4-Chlorophenylaminocarbonyl)benzyl]-5-(trifluoromethyl)-2-pyridone
Acetyl-2,3,4,6-tetra-O-acetyl-5-thio-d-glucopyranoside
(E)-6-(4-O-beta-D-glucopyranosyl-styryl)-4-methoxy-2-pyrone|6-[(E)-2-(4-(beta-D-glucopyranosyloxy)phenyl)ethenyl]-4-methoxy-2H-pyran-2-one|desmethylyangonin-4?-O-beta-D-glucopyranoside|panamin
2,9-Dibenzyl-1,8-dioxa-2,9-diaza-dispiro[3.2.3.2]dodeca-5,11-dien-3,10-dithion|2,9-dibenzyl-1,8-dioxa-2,9-diaza-dispiro[3.2.3.2]dodeca-5,11-diene-3,10-dithione
OCHROCARPIN C
A furanocoumarin that is 2H-furo[2,3-h]chromen-2-one substituted by a hydroxy group at position 5, 2-hydroxypropan-2-yl group at position 8, a 2-methylpropanoyl group at position 6 and a phenyl group at position 4. Isolated from the bark of Ochrocarpos punctatus, it exhibits cytotoxicity against the A2780 ovarian cancer cell line.
4-chloro-5-O-methyl-3,4-deoxypsorospermin-3,5-diol
1,5-dihydroxyxanthone-6-O-beta-D-glucoside|1,5-Dihydroxyxanthone-6-O-??-D-glucoside
2-(4-O-benzoyl-beta-D-glucopyranosyloxy)-5-hydroxybenzyl alcohol
2-hydroxy-4-hydroxymethylphenyl-(6-O-benzoyl)-beta-D-allopyranoside|Pilorubrosin|pilorubrosine
(6aS)-3-(2-hydroxy-6-methylphenyl)-6a-methyl-9-(2-methylbutyryl)-6aH-furo[2,3-h]isochromene-6,8-dione|multiformin C
Quzhaqigan
Piceatannol 3-O-glucoside is a natural product found in Rheum undulatum, Rheum rhabarbarum, and Rheum rhaponticum with data available. Piceatannol 3'-O-glucoside, an active component of Rhubarb, activates endothelial nitric oxide (NO) synthase through inhibition of arginase activity with IC50s of 11.22 μM and 11.06 μM against arginase I and arginase II, respectively. Piceatannol 3'-O-glucoside, an active component of Rhubarb, activates endothelial nitric oxide (NO) synthase through inhibition of arginase activity with IC50s of 11.22 μM and 11.06 μM against arginase I and arginase II, respectively.
erigeroflavanone|methyl 2-[rel-(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2-(3,4-dihydroxyphenyl)-2-methoxy-4-oxo-2H-chromen-3-yl]acetate|rel-(2R,3R)-3,5,7,3,4-pentahydroxy-2-methoxy-flavanone-3-acetic acid methyl ester
2-(4-Hydroxyphenyl)-5,7-dihydroxy-6-[2-hydroxy-5-(hydroxycarbonyl)phenyl]-4H-1-benzopyran-4-one
6-oxo-6a,12a-dehydrodeguelin|9,10-dimethoxy-3,3-dimethyl-3H-pyrano[2,3-c;6,5-f] dichromium ene-7,13-dione|9,10-Dimethoxy-3,3-dimethyl-3H-pyrano[2,3-c;6,5-f]dichromen-7,13-dion|villosinol
benzyl-4-hydroxy-benzoyl-3-O-beta-D-glucopyranoside
3,4-dihydro-7-hydroxy-4-(3,4-dihydroxyphenyl)-5-[(1E)-2-(3,4-dihydroxyphenyl)ethenyl]-2H-1-benzopyran-2-one|gnetumontanin F
4-O-beta-D-glucopyranosyl-1,7-dihydroxyxanthone|tenuiside A
2-O-beta-D-glucopyranosyl-4-hydroxy-6-methoxybenzophenone|tenuiside C
(2R,3S)-trans-2-(4-hydroxy-3-methoxyphenyl)-2,3,5,6-tetrahydrophenanthro[2,1-b]pyran-3,8,11-triol|chrysotoxol A
(1S,3R,5R,7S,8S,9S)-5,8-dihydroxy-3-methoxy-1-isovaleroxyvalechlorine|chlorovaltrate B
benzyl 2-hydroxy-4-O-beta-D-glucopyranosyl benzoate
(1S,5R,7S,8S,9S)-7-acetoxy-10-chloro-5-hydroxy-1-isovaleroxy-11-methoxy-5,6-dihydrovaltrate chlorohydrin|chlorovaltrate H
4-O-beta-D-glucopyranosyl-2-hydroxy-6-methoxybenzophenone|tenuiside B
3-O-beta-D-Glucopyranoside-1,2-Bis(3,4-dihydroxyphenyl)ethylene
benzoyloxymethyl-3-hydroxy-phenyl-4-beta-D-glucopyranoside|salviifoside A
2-benzyl-4,6-dihydroxy benzoic acid-4-O-beta-D-glucopyranoside
2-(3-O-benzoyl-beta-D-glucopyranosyloxy)-5-hydroxybenzyl alcohol
2-carboxy-3,4-dihydroxy-5-beta-D-xylopyranosyloxybibenzyl|2-Carboxyl-3,4-dihydroxy-5-??-D-xylopyranosyloxybibenzyl
2-benzyl-4,6-dihydroxy benzoic acid-6-O-beta-D-glucopyranoside
(E)-2-O-beta-D-Glucopyranoside-1-(4-Hydroxyphenyl)-2-(2,4,6-trihydroxyphenyl)ethylene
2-(1,3-Benzodioxole-5-ylcarbonyl)-1-(4-methoxybenzofuran-5-yl)-3,3-dimethyl-4-pentene-1-one
1,7-dihydroxyxanthone-3-O-beta-D-glucopyranoside|xanthohypericoside
Oxyresveratrol 2-O-β-D-glucopyranoside
Oxyresveratrol 2-O-beta-D-glucopyranoside is a natural product found in Schoenocaulon officinale, Morus alba, and Morus nigra with data available. Oxyresveratrol 2-O-β-D-glucopyranoside is a phenolic compound isolated from Morus nigra root and is an effective tyrosinase inhibitor with an IC50 of 29.75 μM[1].
Oxyresveratrol 3-O-β-D-glucopyranoside
Oxyresveratrol 3-O-beta-D-glucopyranoside is a natural product found in Veratrum grandiflorum, Schoenocaulon officinale, and other organisms with data available.
ginkgolide K
Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1]. Ginkgolide K, isolated from Ginkgo biloba, induces protective autophagy through the AMPK/mTOR/ULK1 signaling pathway. Ginkgolide K possesses neuroprotective activity[1].
(E)-Astringin
Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1]. Astringin (trans-Astringin) is a natural glycoside found in the bark of Picea sitchensis and Picea abies (Norway spruce), in Vitis vinifera cell cultures and in wine. Astringin has potent antioxidant capacity and cancer-chemopreventive activity[1].
C20H22O9_3,5-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl pentofuranoside
C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate
C20H22O9_4-Hydroxy-2-(hydroxymethyl)phenyl 2-O-benzoyl-beta-D-glucopyranoside
7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5-diol
floctafenine
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics N - Nervous system > N02 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents
SB281832
CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7957; ORIGINAL_PRECURSOR_SCAN_NO 7956 CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7921; ORIGINAL_PRECURSOR_SCAN_NO 7919 CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7996; ORIGINAL_PRECURSOR_SCAN_NO 7995 CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8005; ORIGINAL_PRECURSOR_SCAN_NO 8002 CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7977; ORIGINAL_PRECURSOR_SCAN_NO 7976 CONFIDENCE standard compound; INTERNAL_ID 341; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8009; ORIGINAL_PRECURSOR_SCAN_NO 8006
Ala Asp Asp Ser
Ala Asp Ser Asp
Ala Ser Asp Asp
Cys Gly Met Pro
Cys Gly Asn Asn
Cys Gly Pro Met
Cys Met Gly Pro
Cys Met Pro Gly
Cys Asn Gly Asn
Cys Asn Asn Gly
Cys Pro Gly Met
Cys Pro Met Gly
Asp Ala Asp Ser
Asp Ala Ser Asp
Asp Asp Ala Ser
Asp Asp Gly Thr
Asp Asp Ser Ala
Asp Asp Thr Gly
Asp Glu Gly Ser
Asp Glu Ser Gly
Asp Gly Asp Thr
Asp Gly Glu Ser
Asp Gly Ser Glu
Asp Gly Thr Asp
Asp Ser Ala Asp
Asp Ser Asp Ala
Asp Ser Glu Gly
Asp Ser Gly Glu
Asp Thr Asp Gly
Asp Thr Gly Asp
Glu Asp Gly Ser
Glu Asp Ser Gly
Glu Gly Asp Ser
Glu Gly Ser Asp
Glu Ser Asp Gly
Glu Ser Gly Asp
Gly Cys Met Pro
Gly Cys Asn Asn
Gly Cys Pro Met
Gly Asp Asp Thr
Gly Asp Glu Ser
Gly Asp Ser Glu
Gly Asp Thr Asp
Gly Glu Asp Ser
Gly Glu Ser Asp
Gly Met Cys Pro
Gly Met Pro Cys
Gly Asn Cys Asn
Gly Asn Asn Cys
Gly Pro Cys Met
Gly Pro Met Cys
Gly Ser Asp Glu
Gly Ser Glu Asp
Gly Thr Asp Asp
5-((2-hydroxy-2-methylpropoxy)carbonyl)-2-(hydroxymethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid
Met Cys Gly Pro
Met Cys Pro Gly
Met Gly Cys Pro
Met Gly Pro Cys
Met Pro Cys Gly
Met Pro Gly Cys
Asn Cys Gly Asn
Asn Cys Asn Gly
Asn Gly Cys Asn
Asn Gly Asn Cys
Asn Asn Cys Gly
Asn Asn Gly Cys
Pro Cys Gly Met
Pro Cys Met Gly
Pro Gly Cys Met
Pro Gly Met Cys
Pro Met Cys Gly
Pro Met Gly Cys
Ser Ala Asp Asp
Ser Asp Ala Asp
Ser Asp Asp Ala
Ser Asp Glu Gly
Ser Asp Gly Glu
Ser Glu Asp Gly
Ser Glu Gly Asp
Ser Gly Asp Glu
Ser Gly Glu Asp
Thr Asp Asp Gly
Thr Asp Gly Asp
Thr Gly Asp Asp
Afzelechin 7-apioside
W-Salicoylsalicin
7-Chloro-3,4',5,6,8-pentamethoxyflavone
Benzyl 2,6-dihydroxybenzoate 2-glucoside
(R)-Apiumetin glucoside
Piceatannol 4'-glucoside
Edulisin VI
1-[3-[(E)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropyl]-2-(2-methyl-3-phenylphenyl)ethanone
4-METHYLUMBELLIFERYL-BETA-D-GLUCURONIDE TRIHYDRATE
N-(5-Chloro-2-pyridinyl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide
(2R)-4-[5-Chloro-2-[(4-methoxyphenyl)thio]phenyl]-2-methyl-1-piperazineacetic acid
1-PYRROLIDIN-2-(3,5-DICHLOROPHENYL)-2-(N-CBZ-N-METHYL)AMINO-ETHANE
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-acetylsulfanyloxan-2-yl]methyl acetate
(R)-4-(2-(IODOMETHYL)-3-METHYLBUTYL)-1-METHOXY-2-(3-METHOXYPROPOXY)BENZENE
Bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate
3,4-Bis(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)benzamide
(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-one
((3,5-DICHLORO-4-(3-ISOPROPYL-4-METHOXYPHENOXY)PHENYL)ETHYNYL)TRIMETHYLSILANE
(3aR,4R,5R,6aS)-2-oxo-4-((E)-3-oxo-4-phenoxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-5-yl benzoate
Penamecillin
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CE - Beta-lactamase sensitive penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
N-[5-(diethylamino)-2-[(3,5-dinitro-2-thienyl)azo]phenyl]acetamide
2,6-Diazaspiro[3.3]heptane, 2,6-bis[(4-Methylphenyl)sulfonyl]-
N-(PIPERIDIN-4-YL)-1-TOSYL-1H-BENZO[D]IMIDAZOL-2-AMINE HYDROCHLORIDE
CPPHA
CPPHA is potent and selective positive allosteric modulator (PAM) of the mGluR5 and mGluR1 (metabotropic glutamate receptor). CPPHA can potentiate responses of mGluR5 and mGluR1 to activation of these receptors. CPPHA is developed for the research of central nervous system disorders[1][2].
13-(2-CHLORO-PHENYL)-3,3-DIMETHYL-2,3,4,13-TETRAHYDRO-INDAZOLO[1,2-B]PHTHALAZINE-1,6,11-TRIONE
13-(4-chlorophenyl)-3,3-dimethyl-4,13-dihydro-2H-indazolo[1,2-b]phthalazine-1,6,11-trione
2-Propenoic acid, (4-methyl-1,3-phenylene)bis(iminocarbonyloxy-2,1-ethanediyl) ester
Thioridazine hydrochloride
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Thioridazine hydrochloride, an orally active antagonist of the dopamine receptor D2 family proteins, exhibits potent anti-psychotic and anti-anxiety activities. Thioridazine hydrochloride is also a potent inhibitor of PI3K-Akt-mTOR signaling pathways with anti-angiogenic effect. Thioridazine hydrochloride shows antiproliferative and apoptosis induction effects in various types of cancer cells, with specificity on targeting cancer stem cells (CSCs)[1][2][3][4].
SR 2640 hydrochloride,2-[[3-(2-Quinolinylmethoxy)phenyl]amino]benzoicacidhydrochloride
Carbinoxamine maleate
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist Carbinoxamine maleate salt is a histamine H1 receptor antagonist.
(R)-Lip-L-glu-L-ala-OH
CMX-2043 is a novel analogue of α-Lipoic Acid (HY-N0492). CMX-2043 is effective in antioxidant effect, activation of insulin receptor kinase, soluble tyrosine kinase, and Akt phosphorylation. CMX-2043 shows protection against ischemia-reperfusion injury (IRI) in rat model[1][2]. CMX-2043 is a novel analogue of α-Lipoic Acid (HY-N0492). CMX-2043 is effective in antioxidant effect, activation of insulin receptor kinase, soluble tyrosine kinase, and Akt phosphorylation. CMX-2043 shows protection against ischemia-reperfusion injury (IRI) in rat model[1][2].
spiro(cyclohexane-1,3(1H)-furo(3,4-C)pyridine)-4-carboxamide, N-(1-(2-fluorophenyl)-1h-pyrazol-3-yl)-1-oxo-, trans-
MK-0557 is a highly selective, orally available neuropeptide Y5 receptor antagonist with a Ki of 1.6 nM.
2-(4-((2-(3-Chlorophenyl)-6-(trifluoromethyl)pyrimidin-4-yl)amino)phenyl)acetamide
Peficitinib hydrobromide
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2152 - Phosphatidylinositide 3-Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor
Benzenesulfonamide, N-(((1,1-dimethylethyl)amino)carbonyl)-2-((4-methylphenyl)amino)-5-nitro-
3-[1,1-Biphenyl]-4-yl-N-(phosphonomethyl)alanyl-beta-alanine
1H-Indole-3-carboxylic acid, 1-(((4-methylphenyl)amino)carbonyl)-2-hydroxy-6-(trifluoromethyl)-, ethyl ester
2,3-Dicarboxy-4-(2-chloro-phenyl)-1-ethyl-5-isopropoxycarbonyl-6-methyl-pyridinium
(2r)-2-[(1r)-1-{[(2s)-2-Carboxy-2-(4-Hydroxyphenyl)acetyl]amino}-1-Methoxy-2-Oxoethyl]-5-Methylidene-5,6-Dihydro-2h-1,3-Oxazine-4-Carboxylic Acid
(2S,3R,4S,5S,6R)-2-[2-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
3-Ethyl-3,6,6-trihydroxy-5-oxa-9,19-diazahexacyclo[15.4.1.02,7.09,21.011,20.013,18]docosa-1(21),2(7),11(20),12,14,16,18-heptaene-4,8,22-trione
2-[2,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
1-(2,3-Dihydroxyphenyl)-2-phenyl-2-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethanone
2-[2,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-3,4,5,6-tetrahydroxyhexanal
2-[3-[(Z)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
cis-Astringin
A stilbenoid that is cis-3,5,3,4-tetrahydroxystilbene substituted at position 3 by a beta-D-glucosyl residue.
2-[(3-Cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid
N-(4-methyl-2-pyridinyl)-2-[3-(trifluoromethyl)phenyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbothioamide
6,7,8-Trimethoxy-2-(2-phenoxypyridin-3-yl)-3,1-benzoxazin-4-one
N-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)-4-pyrazolyl]methyl]-2-(2-pyridinyl)ethanamine
N-[(2-chlorophenyl)methyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide
N-[2-methoxy-5-(2-oxo-1-benzopyran-3-yl)phenyl]-5-nitro-2-furancarboxamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(2-methyl-3-furanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]thio]acetamide
4-[[(2,4-difluoroanilino)-sulfanylidenemethyl]hydrazo]-N-(3,4-dimethylphenyl)-4-oxobutanamide
2-[(E)-{2-[(3-fluorophenyl)carbonyl]hydrazinylidene}methyl]phenyl 1,3-benzodioxole-5-carboxylate
N-(2,4-dimethoxyphenyl)-3-(2-furoylamino)-1-benzofuran-2-carboxamide
4-[[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester
3-methyl-N-(1-oxo-2-phenoxyethyl)-1-phenyl-5-thieno[2,3-c]pyrazolecarbohydrazide
1-(4-Chlorophenyl)-3-[3-(3-chlorophenyl)-1,5,5-trimethyl-2-oxoimidazolidin-4-yl]urea
3-(2,4-Dichlorophenoxy)-1-(2,3-dimethylphenyl)-4-(propylaminomethyl)-2-azetidinone
(2S,3R,4R)-3-[4-(2-cyclopropylethynyl)phenyl]-4-(hydroxymethyl)-1-(2-methylphenyl)sulfonyl-2-azetidinecarbonitrile
(2R,3S,4S)-3-[4-(2-cyclopropylethynyl)phenyl]-4-(hydroxymethyl)-1-(2-methylphenyl)sulfonyl-2-azetidinecarbonitrile
[(3aS,4S,9bR)-8-bromo-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-cyclohexylmethanone
[(3aR,4R,9bS)-8-bromo-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-cyclohexylmethanone
[(3aR,4S,9bS)-8-bromo-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-cyclohexylmethanone
[(3aS,4R,9bR)-8-bromo-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-cyclohexylmethanone
3,4,5-Trihydroxy-6-[3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy]oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[3-hydroxy-5-[2-(2-hydroxyphenyl)ethyl]phenoxy]oxane-2-carboxylic acid
6-[3-[2-(3,5-Dihydroxyphenyl)ethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
2-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-3-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
5-Hydroxy-8-(hydroxymethyl)-8-methyl-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-h]chromen-2-one
[(2R,3S,4R,5R)-5-[2-(dimethylamino)-7-methyl-6-oxo-1H-purin-9-ium-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
2-[3-[[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]amino]propanoylamino]ethanesulfonic acid
dihydroresveratrol-3-O-beta-D-glucuronide
A monosaccharide derivative that is the 7-O-glucuronide of dihydroresveratrol .
CGS 7181
LY266097 (hydrochloride)
LY266097 hydrochloride is a selective 5-HT2B receptor antagonist with pKis of 7.7, 9.8, and 7.6 for 5-HT2A, 5-HT2B, 5-HT2C, respectively. 5-HT2B receptor blockade contributes to the research in depression[1].
WAY-354574
WAY-354574 is an active molecule targeting deacetylase (Sirtuin) for the study of Huntington's disease (HD)[1].
(2s,3r,4s,5r,6r)-2-{2,4-dihydroxy-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
5,5',6,6',7,7'-hexahydroxy-3-methoxy-4,8'-dimethyl-1'h,3h-spiro[2-benzofuran-1,3'-[2]benzopyran]-4'-one
(2s)-5-hydroxy-8-[(2-hydroxy-5-methoxyphenyl)methyl]-7-methoxy-2-phenyl-2,3-dihydro-1-benzopyran-4-one
methyl 5-hydroxy-3-methoxy-4-methyl-7-{2-[2-(prop-1-en-2-yl)-1,3-thiazol-4-yl]-1,3-thiazol-4-yl}hepta-2,6-dienoate
(12r,15s,16s)-14,14,15-trimethyl-6-oxo-4-phenyl-3,11,13-trioxatetracyclo[8.6.0.0²,⁷.0¹²,¹⁶]hexadeca-1,4,7,9-tetraen-15-yl acetate
(6as)-3-(2-hydroxy-6-methylphenyl)-6a-methyl-9-[(2r)-2-methylbutanoyl]furo[2,3-h]isochromene-6,8-dione
(2s,3r,4r,5s,6r)-2-[(9r)-4,5-dihydroxy-2-(hydroxymethyl)-9h-xanthen-9-yl]-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-{2-[(1e)-2-(3,5-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
2-chloro-1,3,6,8-tetrahydroxy-7-[(1s)-1-hydroxyhexyl]anthracene-9,10-dione
4-methoxy-6-[(1e)-2-(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethenyl]pyran-2-one
2-chloro-1,3,6,8-tetrahydroxy-7-(1-hydroxyhexyl)anthracene-9,10-dione
(2s)-5-hydroxy-6-[(2-hydroxy-5-methoxyphenyl)methyl]-7-methoxy-2-phenyl-2,3-dihydro-1-benzopyran-4-one
methyl (10s,12r,14s,16s)-6,12-dihydroxy-4,14-dimethoxy-10-methyl-8-oxo-9,15-dioxatetracyclo[8.7.0.0²,⁷.0¹²,¹⁶]heptadeca-1(17),2,4,6-tetraene-14-carboxylate
2-(4,5-dihydroxy-2-methoxyphenyl)-5,7-dihydroxy-3,6,8-trimethoxychromen-4-one
(4-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl benzoate
2-{[2-(3,4-dihydroxyphenyl)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}oxane-3,4,5-triol
(4r)-4-(3,4-dihydroxyphenyl)-5-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-7-hydroxy-3,4-dihydro-1-benzopyran-2-one
2-(2,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3,6,8-trimethoxychromen-4-one
(2s,3r,4s,5s,6r)-2-{2,4-dihydroxy-5-[(1e)-2-(4-hydroxyphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3s,4r,5s)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}oxane-3,4,5-triol
1-(4-hydroxyphenyl)-2-(2,4,6-trihydroxyphenyl)ethylene
{"Ingredient_id": "HBIN001502","Ingredient_name": "1-(4-hydroxyphenyl)-2-(2,4,6-trihydroxyphenyl)ethylene","Alias": "NA","Ingredient_formula": "C20H22O9","Ingredient_Smile": "NA","Ingredient_weight": "406.38","OB_score": "NA","CAS_id": "162107-29-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9668","PubChem_id": "NA","DrugBank_id": "NA"}
1,5-dihydroxyxanthone-6-o-β-d-glucoside
{"Ingredient_id": "HBIN001662","Ingredient_name": "1,5-dihydroxyxanthone-6-o-\u03b2-d-glucoside","Alias": "1,5-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one; 1,5-dihydroxyxanthone-6-o-beta-d-glucoside; 1,5-Dihydroxy-6-(beta-D-glucopyranosyloxy)xanthone; AC1NSUSA","Ingredient_formula": "C19H18O10","Ingredient_Smile": "C1=CC(=C2C(=C1)OC3=C(C2=O)C=CC(=C3O)OC4C(C(C(C(O4)CO)O)O)O)O","Ingredient_weight": "406.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15140;SMIT18990","TCMID_id": "25863;6183","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5316845","DrugBank_id": "NA"}
2-carboxyl-3,4'-dihydroxy-5-β-d-xylopyra-nosyloxybibenzyl
{"Ingredient_id": "HBIN005445","Ingredient_name": "2-carboxyl-3,4'-dihydroxy-5-\u03b2-d-xylopyra-nosyloxybibenzyl","Alias": "NA","Ingredient_formula": "C20H22O9","Ingredient_Smile": "C1C(C(C(C(O1)OC2=CC(=C(C(=C2)CCC3=CC=C(C=C3)O)C(=O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3175","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
benzyl 2-o-β-d-glucopyranosyl-2,6-dihydroxy-benzoate
{"Ingredient_id": "HBIN017840","Ingredient_name": "benzyl 2-o-\u03b2-d-glucopyranosyl-2,6-dihydroxy-benzoate","Alias": "NA","Ingredient_formula": "C20H22O9","Ingredient_Smile": "C1=CC=C(C=C1)COC(=O)C2=C(C=CC=C2OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2288","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
