Exact Mass: 466.1219320000001
Exact Mass Matches: 466.1219320000001
Found 500 metabolites which its exact mass value is equals to given mass value 466.1219320000001,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Agnuside
C22H26O11 (466.14750460000005)
Agnuside is a benzoate ester resulting from the formal condensation of the carboxy group of 4-hydroxybenzoic acid with the primary hydroxy group of aucubin. It is an iridoid glycoside found in several Vitex plants including Vitex agnus-castus. It has a role as a plant metabolite, an anti-inflammatory agent, a pro-angiogenic agent and a cyclooxygenase 2 inhibitor. It is a terpene glycoside, an iridoid monoterpenoid, a benzoate ester, a member of phenols, a beta-D-glucoside, a cyclopentapyran and a monosaccharide derivative. It is functionally related to an aucubin. Agnuside is a natural product found in Crescentia cujete, Vitex peduncularis, and other organisms with data available. See also: Chaste tree fruit (part of); Vitex negundo leaf (part of). Isolated from Vitex agnus-castus (agnus castus). Agnuside is found in herbs and spices and fruits. Agnuside is found in fruits. Agnuside is isolated from Vitex agnus-castus (agnus castus). Agnuside is a compound isolated from Vitex negundo, down-regulates pro-inflammatory mediators PGE2 and LTB4, and reduces the expression of cytokines, with anti-arthritic activity[1]. Agnuside is used in the study of asthma, inflammation, and angiogenic diseases. Agnuside is an orally active compound that can be extracted from Vitex negundo[1][2][3][4]. Agnuside is a compound isolated from Vitex negundo, down-regulates pro-inflammatory mediators PGE2 and LTB4, and reduces the expression of cytokines, with anti-arthritic activity[1].
Plantagoside
Plantagoside is a flavanone glycoside that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 4 and 5 and a beta-D-glucopyranosyloxy group at position 3 respectively. It has a role as a plant metabolite. It is a flavanone glycoside, a tetrahydroxyflavanone, a monosaccharide derivative, a beta-D-glucoside and a member of 4-hydroxyflavanones. It is functionally related to a (2S)-flavanone. Plantagoside is a natural product found in Plantago asiatica, Plantago major, and other organisms with data available. A flavanone glycoside that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 4 and 5 and a beta-D-glucopyranosyloxy group at position 3 respectively. Plantagoside, isolated from the seeds of Plantago asiatica, is a specific and non-competitive inhibitor for jack bean α-mannosidase, with an IC50 of 5 μM[1]. Plantagoside, isolated from the seeds of Plantago asiatica, is a specific and non-competitive inhibitor for jack bean α-mannosidase, with an IC50 of 5 μM[1].
Silandrin
Constituent of Silybum marianum (milk thistle). Silandrin is found in coffee and coffee products and green vegetables. Silandrin is found in coffee and coffee products. Silandrin is a constituent of Silybum marianum (milk thistle).
Glucodistylin
Glucodistylin is a polyphenol compound found in foods of plant origin (PMID: 20428313). A polyphenol compound found in foods of plant origin (PhenolExplorer)
Silyhermin
Constituent of Silybum marianum (milk thistle). Silyhermin is found in coffee and coffee products and green vegetables. Silyhermin is found in coffee and coffee products. Silyhermin is a constituent of Silybum marianum (milk thistle).
Melledonal B
C23H27ClO8 (466.13943720000003)
Melledonal B is found in mushrooms. Melledonal B is from Armillaria mellea (honey mushroom). From Armillaria mellea (honey mushroom). Melledonal B is found in mushrooms.
Neosilyhermin A
Constituent of Silybum marianum (milk thistle). Neosilyhermin A is found in coffee and coffee products and green vegetables. Neosilyhermin B is found in coffee and coffee products. Neosilyhermin B is a constituent of Silybum marianum (milk thistle).
BL IV
BL IV is found in mushrooms. BL IV is a constituent of the kurukawa mushroom (Boletopsis leucomelas) (edibility not reported)
Spirapril
Spirapril is an ACE inhibitor antihypertensive drug used to treat hypertension. Like many ACE inhibitors, this is a prodrug which is converted to the active metabolite spiraprilat following oral administration. ACE inhibitors are used primarily in treatment of hypertension and congestive heart failure. C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
hesperetin-7-O-glucuronide
hesperetin-7-O-glucuronide is metabolite of the citrus fruit hesperitin.
(-)-Epicatechin 3'-O-glucuronide
(-)-Epicatechin 3-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
(-)-Epicatechin 7-O-glucuronide
(-)-Epicatechin 7-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Catechin 7-glucuronide
Catechin 7-glucuronide belongs to the class of organic compounds known as flavonoid-7-O-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position. BioTransformer predicts that catechin 7-glucuronide is a product of catechin metabolism via an aromatic-OH-glucuronidation and catalyzed by the UDP-glucuronosyltransferase 1-1 (P22309) enzyme (PMID: 30612223).
Catechin 3'-glucuronide
Catechin 3-glucuronide belongs to the class of organic compounds known as flavonoid O-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid. BioTransformer predicts that catechin 3-glucuronide is a product of catechin metabolism via an aromatic-OH-glucuronidation and catalyzed by the UDP-glucuronosyltransferase 1-1 (P22309) enzyme (PMID: 30612223).
Catechin 3-glucuronide
Epicatechin 3-glucuronide
Catechin 4'-glucuronide
Catechin 5-glucuronide
Epicatechin 4'-glucuronide
Epicatechin 5-O-glucuronide
Epicatechin 5-O-glucuronide (E5G) belongs to the class of organic compounds known as flavonoid O-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid. E5G is an extremely weak basic (essentially neutral) compound (based on its pKa).
Acyclonucleoside
benfotiamine
C19H23N4O6PS (466.10758680000004)
A - Alimentary tract and metabolism > A11 - Vitamins > A11D - Vitamin b1, plain and in combination with vitamin b6 and b12 > A11DA - Vitamin b1, plain D064449 - Sequestering Agents > D002614 - Chelating Agents D007155 - Immunologic Factors
Curculigoside
C22H26O11 (466.14750460000005)
Esaxerenone
C22H21F3N2O4S (466.11740620000006)
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent
(4-Chlorophenyl) (1R)-6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
C25H20Cl2N2O3 (466.08509100000003)
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-[2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)phenoxy]oxane-2-carboxylic acid
(2S,3S,4S,5R)-6-[[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Atecegatran
C21H21ClF2N4O4 (466.1219320000001)
Dihydromyricetin 3-rhamnoside
Dihydromyricetin 3-rhamnoside is a member of the class of compounds known as flavonoid-3-o-glycosides. Flavonoid-3-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Dihydromyricetin 3-rhamnoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Dihydromyricetin 3-rhamnoside can be found in grape wine, which makes dihydromyricetin 3-rhamnoside a potential biomarker for the consumption of this food product.
Curculigoside_A
C22H26O11 (466.14750460000005)
Curculigoside is a natural product found in Curculigo pilosa, Curculigo sinensis, and other organisms with data available. Curculigoside is the main saponin in C. orchioide, exerts significant antioxidant, anti-osteoporosis, antidepressant and neuroprotection effects. Curculigoside possesses significant anti-arthritic effects in vivo and in vitro via regulation of the JAK/STAT/NF-κB signaling pathway[1]. Curculigoside is the main saponin in C. orchioide, exerts significant antioxidant, anti-osteoporosis, antidepressant and neuroprotection effects. Curculigoside possesses significant anti-arthritic effects in vivo and in vitro via regulation of the JAK/STAT/NF-κB signaling pathway[1].
3,5,7,3,4-Pentahydroxyflavanone 7-alpha-D-glucopyranoside
Catechin 5-O-beta-D-glucopyranoside-4-Me
C22H26O11 (466.14750460000005)
Polystachin (flavone)
Symplocoside
C22H26O11 (466.14750460000005)
6-O-(4-hydroxybenzoyl)-6-epiaucubin
C22H26O11 (466.14750460000005)
Oxypeucedanin hydrate 3-O-beta-glucopyranoside
C22H26O11 (466.14750460000005)
Silymonin
Catechin-4-ol 3-methyl ether 3-O-alpha-L-rhamnopyranoside
C22H26O11 (466.14750460000005)
Taxifolin 7-glucoside
Taxifolin 7-glucoside is a natural product found in Podocarpus nivalis, Picea abies, and other organisms with data available. Taxifolin 7-O-β-D-glucoside (Taxifolin 7-O-glucoside) is one of the main metabolites at the seed germination stage in Scutellaria baicalensis. Taxifolin 7-O-β-D-glucoside, a flavonoid, mainly exists in the episperm and participates in defending against pathogens and UV-damage[1].
Isoglucodistylin
Neosilyhermin A
Silandrin
A flavonolignan isolated from milk thistle, Silybum marianum, and has been shown to exhibit hepatoprotective activity.
CP-471358
CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4194; ORIGINAL_PRECURSOR_SCAN_NO 4193 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4227; ORIGINAL_PRECURSOR_SCAN_NO 4226 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4216; ORIGINAL_PRECURSOR_SCAN_NO 4215 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4209; ORIGINAL_PRECURSOR_SCAN_NO 4208 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4226; ORIGINAL_PRECURSOR_SCAN_NO 4225 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4182; ORIGINAL_PRECURSOR_SCAN_NO 4177 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8683; ORIGINAL_PRECURSOR_SCAN_NO 8681 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8696; ORIGINAL_PRECURSOR_SCAN_NO 8693 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8719; ORIGINAL_PRECURSOR_SCAN_NO 8714 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8737; ORIGINAL_PRECURSOR_SCAN_NO 8734 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8736; ORIGINAL_PRECURSOR_SCAN_NO 8733 CONFIDENCE standard compound; INTERNAL_ID 1259; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8747; ORIGINAL_PRECURSOR_SCAN_NO 8743
EP_M467
C20H20ClFN4O4S (466.08777620000006)
CONFIDENCE Transformation product, tentative ID (Level 3 structure); INTERNAL_ID 2204
rel-(2R,3S)-3-hydroxymethyl-9-methoxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-2,3,6,7-tetrahydrophenanthro[4,3-b]furan-5,11-diol
5-O-beta-D-(6-O-vanilloylglucopyranosyl)gentisic acid|5-O-??-D-(6-O-Vanilloyl glucopyranosyl) gentisic acid
7-O-Methyl leucopelargonidin-3-mono-glucofuranoside
C22H26O11 (466.14750460000005)
2-O-beta-D-Glucopyranoside-2,3,4,5,7-Pentahydroxyflavanone
15-Acetyl-13alpha(21)-epoxyeurycomanone
C22H26O11 (466.14750460000005)
Acumitin
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 3, a 2-hydroxybenzyl group at position 2 and a 3-phenylpropanoyl group at position 4. It is isolated from the roots of Uvaria acuminata and exhibits potent cytotoxicity against human promyelocytic leukemia HL-60 cells.
2-methoxy-3,4,6-trihydroxy-alpha-chalcanol-alpha,beta-epoxide-4-O-beta-D-glucopyranoside|trifochalcanoloside II
C22H26O11 (466.14750460000005)
Agnuside
C22H26O11 (466.14750460000005)
Agnuside is a benzoate ester resulting from the formal condensation of the carboxy group of 4-hydroxybenzoic acid with the primary hydroxy group of aucubin. It is an iridoid glycoside found in several Vitex plants including Vitex agnus-castus. It has a role as a plant metabolite, an anti-inflammatory agent, a pro-angiogenic agent and a cyclooxygenase 2 inhibitor. It is a terpene glycoside, an iridoid monoterpenoid, a benzoate ester, a member of phenols, a beta-D-glucoside, a cyclopentapyran and a monosaccharide derivative. It is functionally related to an aucubin. Agnuside is a natural product found in Crescentia cujete, Vitex peduncularis, and other organisms with data available. See also: Chaste tree fruit (part of); Vitex negundo leaf (part of). A benzoate ester resulting from the formal condensation of the carboxy group of 4-hydroxybenzoic acid with the primary hydroxy group of aucubin. It is an iridoid glycoside found in several Vitex plants including Vitex agnus-castus. Agnuside is a compound isolated from Vitex negundo, down-regulates pro-inflammatory mediators PGE2 and LTB4, and reduces the expression of cytokines, with anti-arthritic activity[1]. Agnuside is used in the study of asthma, inflammation, and angiogenic diseases. Agnuside is an orally active compound that can be extracted from Vitex negundo[1][2][3][4]. Agnuside is a compound isolated from Vitex negundo, down-regulates pro-inflammatory mediators PGE2 and LTB4, and reduces the expression of cytokines, with anti-arthritic activity[1].
6-acetylsalicortin|6?-O-acetylsalicortin
C22H26O11 (466.14750460000005)
2-(3,4-dihydroxyphenyl)ethyl 3-O-(3,4-dihydroxyphenylethanoyl)-beta-D-glucopyranoside|ternstroside C
C22H26O11 (466.14750460000005)
3,4-Dimethoxy-5,8-dihydroxy-xanthon-1-O-beta-D-glucopyranosid|corymbiferin 1-O-glucoside|corymbiferin-1-O-glucoside
(2R)-2,4,6-trihydroxy-2-[(3,4-dihydroxyphenyl)methyl]-3(2H)-benzofuranone-4-yl-beta-D-glucopyranoside|alphitonin-4-O-beta-D-glucopyranoside
quercetin 3-(beta-D-glucopyranoside)|quercetin-3-O-glucoside
(-)(2S)-5,6,7,3,5-pentahydroxyflavanone-7-O-beta-D-glucopyranoside
3,3-Bis(hydroxymethyl)-4,4,8,8-tetramethoxy-2,2-binaphthalene-1,1-diol
9,8-[1-Hydroxy-2-(4-hydroxyphenyl)ethylene]-13-oxa-13H-indeno[1,2-l]phenanthrene-3,5,7,11-tetraol
2-Hydroxy-5-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-4,6-dimethylbenzoic acid 3-hydroxy-2,5-dimethylphenyl ester
(+)-4-methylcatechin-7-O-beta-D-glucopyranoside
C22H26O11 (466.14750460000005)
1,3-dimethoxyl-4-hydroxyalangifolioside
C22H26O11 (466.14750460000005)
4-O-(6-vanilloyl)-beta-D-glucopyranosyl vanillyl alcohol|saccharumoside B
C22H26O11 (466.14750460000005)
2-(hydroxymethyl)-4-oxo-4Hpyran-3-yl 3-O-beta-D-glucopyranosyl-beta-D-glucopyranoside|petrorhagioside A
(3R,3aR,6R,7aR,8R)-(9CI)|4-[(2S)-3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl]-2,3,3a,7a-tetrahydro-7a-hydroxy-8-(4-hydroxy-3-methoxyphenyl)-3,6-methanobenzo-furan-7(6H)-one|silydianin|silymonin
2-(hydroxymethyl)-4-oxo-4H-pyran-3-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside|petrorhagioside C
epicatechin-(7,8-bc)-4alpha-(3-methoxy-4-hydroxy-phenyl)-dihydro-2(3H)-pyranone|smiglabrone B
4-chloro-5-hydroxyl-3-methyl-phenyl O-alpha-L-rhamnopyranosyl-(1?6)-beta-D-glucopyranoside
C19H27ClO11 (466.12418219999995)
1-O-(beta-D-glucopyranosyl)-4,7-dihydroxy-3,8-dimethoxyxanthone|kouitchenside C
1-(4-beta-D-Glucopyranosyloxy-2,6-dihydroxy-phenyl)-3-(3-hydroxy-4-methoxy-phenyl)-propan-1-on|1-(4-beta-D-glucopyranosyloxy-2,6-dihydroxy-phenyl)-3-(3-hydroxy-4-methoxy-phenyl)-propan-1-one|hesperetin dihydrochalcone 4-beta-D-glucoside|Hesperetin-dihydrochalkon-glucosid|hesperitin dihydrochalcone 4-beta-D-glucopyranoside
C22H26O11 (466.14750460000005)
(2R,3S)-3,4-dihydro-2-(3,4-dihydroxyphenyl)-3-hydroxy-7-methoxy-2H-chromen-5-yl beta-D-glucopyranoside|7-O-methylcatechin 5-O-beta-D-glucopyranoside
C22H26O11 (466.14750460000005)
6-carboxy-2,6-dihydroxy-2-beta-glucopyranosyloxy-4-hydroxymethyl-benzophenone|cassiaphenone A-2-glucoside
2-(3,4-dihydroxyphenyl)ethyl 2-O-(3,4-dihydroxyphenylethanoyl)-beta-D-glucopyranoside|ternstroside A
C22H26O11 (466.14750460000005)
4-O-beta-D-(6-O-gentisoylglucopyranosyl)vanillic acid
2-(3,4-dihydroxyphenyl)ethyl 6-O-(3,4-dihydroxyphenylethanoyl)-beta-D-glucopyranoside|ternstroside D
C22H26O11 (466.14750460000005)
11-O-galloylbergenin|11-O-Galloylnorbergenin|6-O-galloylnorbergenin
(2S,3S)-(-)-Taxifolin 3-glucoside;(2S,3S)-Taxifolin 3-glucoside
isoquercitrin|taxifolin 3-O-beta-D-glucopyranoside
3-O-beta-D-glucopyranosyl-4-O-methylrobinetinidol
C22H26O11 (466.14750460000005)
3-methoxy-4-O-beta-D-glucopyranosylbenzyl vanilloate|litseaefoloside B
C22H26O11 (466.14750460000005)
1-O-beta-D-(3,4-dihydroxypheny1)-ethyl-6-O-vanilloyl-glucopyranoside|1-O-??-D-(3,4-Dihydroxyphenyl)-ethyl-6-O-vanilloyl-glucopyranoside
C22H26O11 (466.14750460000005)
dahurin B|sec-O-beta-D-glucopyranosyl-(R)-heraclenol
C22H26O11 (466.14750460000005)
benfotiamine
C19H23N4O6PS (466.10758680000004)
A - Alimentary tract and metabolism > A11 - Vitamins > A11D - Vitamin b1, plain and in combination with vitamin b6 and b12 > A11DA - Vitamin b1, plain D064449 - Sequestering Agents > D002614 - Chelating Agents D007155 - Immunologic Factors
Ala Asp Phe Asp
C20H26N4O9 (466.16997060000006)
(E)-1-(glutathion-S-yl)-N-hydroxy-omega-(methylsulfanyl)hexan-1-imine
1-(3,4-dihydroxyphenyl)-3-(3-C-glucosyl-2,4,6-trihydroxyphenyl)propane-1,3-dione
N-(beta-D-glucosyl)-(indol-3-yl)acetyl-L-glutamate
AChE/BChE-IN-11
(2S,3S)-3,5,7-trihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
4-[2-hydroxy-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]furo[3,2-g]chromen-7-one
C22H26O11 (466.14750460000005)
4-[(2S,3R,4S,5S,6R)-6-[(3,4-dihydroxybenzoyl)oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-methoxybenzoic acid
4-[(2S)-2-hydroxy-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]furo[3,2-g]chromen-7-one
C22H26O11 (466.14750460000005)
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one
(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
C22H26O11_beta-D-Glucopyranoside, (1aS,1bS,2S,5aR,6S,6aS)-6-(benzoyloxy)-1a,1b,2,5a,6,6a-hexahydro-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl
C22H26O11 (466.14750460000005)
C22H26O11_Benzoic acid, 4-hydroxy-, 1-(hexopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-5-yl ester
C22H26O11 (466.14750460000005)
C22H26O11_2-Cyclohexene-1-carboxylic acid, 1-hydroxy-6-oxo-, [2-[(2-O-acetyl-beta-D-glucopyranosyl)oxy]phenyl]methyl ester
C22H26O11 (466.14750460000005)
[(1aS,1bS,2S,5aR,6S,6aS)-1a-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5a,6,6a-tetrahydro-1bH-oxireno[5,6]cyclopenta[1,3-c]pyran-6-yl] benzoate
C22H26O11 (466.14750460000005)
(2S,3S)-3,5,7-trihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one [IIN-based: Match]
(2S,3S)-3,5,7-trihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000845144]
4-[2-hydroxy-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]furo[3,2-g]chromen-7-one [IIN-based on: CCMSLIB00000846431]
C22H26O11 (466.14750460000005)
4-[2-hydroxy-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]furo[3,2-g]chromen-7-one [IIN-based: Match]
C22H26O11 (466.14750460000005)
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one [IIN-based: Match]
[(1aS,1bS,2S,5aR,6S,6aS)-1a-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5a,6,6a-tetrahydro-1bH-oxireno[5,6]cyclopenta[1,3-c]pyran-6-yl] benzoate_major
C22H26O11 (466.14750460000005)
Ala Asp Asp Phe
C20H26N4O9 (466.16997060000006)
Ala Asp Met Met
Ala Phe Asp Asp
C20H26N4O9 (466.16997060000006)
Ala Met Asp Met
Ala Met Met Asp
Cys Cys Glu Ile
Cys Cys Glu Leu
Cys Cys Ile Glu
Cys Cys Lys Asn
Cys Cys Leu Glu
Cys Cys Asn Lys
Cys Cys Asn Gln
Cys Cys Gln Asn
Cys Asp Asp Asp
Cys Asp Glu Thr
C16H26N4O10S (466.1369576000001)
Cys Asp Met Val
Cys Asp Thr Glu
C16H26N4O10S (466.1369576000001)
Cys Asp Val Met
Cys Glu Cys Ile
Cys Glu Cys Leu
Cys Glu Asp Thr
C16H26N4O10S (466.1369576000001)
Cys Glu Glu Ser
C16H26N4O10S (466.1369576000001)
Cys Glu Ile Cys
Cys Glu Leu Cys
Cys Glu Ser Glu
C16H26N4O10S (466.1369576000001)
Cys Glu Thr Asp
C16H26N4O10S (466.1369576000001)
Cys Ile Cys Glu
Cys Ile Glu Cys
Cys Lys Cys Asn
Cys Lys Asn Cys
Cys Leu Cys Glu
Cys Leu Glu Cys
Cys Met Asp Val
Cys Met Val Asp
Cys Asn Cys Lys
Cys Asn Cys Gln
Cys Asn Lys Cys
Cys Asn Gln Cys
Cys Gln Cys Asn
Cys Gln Asn Cys
Cys Ser Glu Glu
C16H26N4O10S (466.1369576000001)
Cys Thr Asp Glu
C16H26N4O10S (466.1369576000001)
Cys Thr Glu Asp
C16H26N4O10S (466.1369576000001)
Cys Val Asp Met
Cys Val Met Asp
Asp Ala Asp Phe
C20H26N4O9 (466.16997060000006)
Asp Ala Phe Asp
C20H26N4O9 (466.16997060000006)
Asp Ala Met Met
Asp Cys Asp Asp
Asp Cys Glu Thr
C16H26N4O10S (466.1369576000001)
Asp Cys Met Val
Asp Cys Thr Glu
C16H26N4O10S (466.1369576000001)
Asp Cys Val Met
Asp Asp Ala Phe
C20H26N4O9 (466.16997060000006)
Asp Asp Cys Asp
Asp Asp Asp Cys
Asp Asp Phe Ala
C20H26N4O9 (466.16997060000006)
Asp Asp Met Ser
C16H26N4O10S (466.1369576000001)
Asp Asp Ser Met
C16H26N4O10S (466.1369576000001)
Asp Glu Cys Thr
C16H26N4O10S (466.1369576000001)
Asp Glu Phe Gly
C20H26N4O9 (466.16997060000006)
Asp Glu Thr Cys
C16H26N4O10S (466.1369576000001)
Asp Met Ala Met
Asp Met Cys Val
Asp Met Asp Ser
C16H26N4O10S (466.1369576000001)
Asp Met Met Ala
Asp Met Ser Asp
C16H26N4O10S (466.1369576000001)
Asp Met Val Cys
Asp Ser Asp Met
C16H26N4O10S (466.1369576000001)
Asp Ser Met Asp
C16H26N4O10S (466.1369576000001)
Asp Thr Cys Glu
C16H26N4O10S (466.1369576000001)
Asp Thr Glu Cys
C16H26N4O10S (466.1369576000001)
Asp Val Cys Met
Asp Val Met Cys
Glu Cys Cys Ile
Glu Cys Cys Leu
Glu Cys Asp Thr
C16H26N4O10S (466.1369576000001)
Glu Cys Glu Ser
C16H26N4O10S (466.1369576000001)
Glu Cys Ile Cys
Glu Cys Leu Cys
Glu Cys Ser Glu
C16H26N4O10S (466.1369576000001)
Glu Cys Thr Asp
C16H26N4O10S (466.1369576000001)
Glu Asp Cys Thr
C16H26N4O10S (466.1369576000001)
Glu Asp Thr Cys
C16H26N4O10S (466.1369576000001)
Glu Glu Cys Ser
C16H26N4O10S (466.1369576000001)
Glu Glu Ser Cys
C16H26N4O10S (466.1369576000001)
Glu Gly Met Met
Glu Ile Cys Cys
Glu Leu Cys Cys
Glu Met Gly Met
Glu Met Met Gly
Glu Ser Cys Glu
C16H26N4O10S (466.1369576000001)
Glu Ser Glu Cys
C16H26N4O10S (466.1369576000001)
Glu Thr Cys Asp
C16H26N4O10S (466.1369576000001)
Glu Thr Asp Cys
C16H26N4O10S (466.1369576000001)
Gly Glu Met Met
Gly Met Glu Met
Gly Met Met Glu
Ile Cys Cys Glu
Ile Cys Glu Cys
Ile Glu Cys Cys
Lys Cys Cys Asn
Lys Cys Asn Cys
Lys Asn Cys Cys
Leu Cys Cys Glu
Leu Cys Glu Cys
Leu Glu Cys Cys
Met Ala Asp Met
Met Ala Met Asp
Met Cys Asp Val
Met Cys Val Asp
Met Asp Ala Met
Met Asp Cys Val
Met Asp Asp Ser
C16H26N4O10S (466.1369576000001)
Met Asp Met Ala
Met Asp Ser Asp
C16H26N4O10S (466.1369576000001)
Met Asp Val Cys
Met Glu Gly Met
Met Glu Met Gly
Met Gly Glu Met
Met Gly Met Glu
Met Met Ala Asp
Met Met Asp Ala
Met Met Glu Gly
Met Met Gly Glu
Met Ser Asp Asp
C16H26N4O10S (466.1369576000001)
Met Val Cys Asp
Met Val Asp Cys
Asn Cys Cys Lys
Asn Cys Cys Gln
Asn Cys Lys Cys
Asn Cys Gln Cys
Asn Lys Cys Cys
Asn Gln Cys Cys
Gln Cys Cys Asn
Gln Cys Asn Cys
Gln Asn Cys Cys
Ser Cys Glu Glu
C16H26N4O10S (466.1369576000001)
Ser Asp Asp Met
C16H26N4O10S (466.1369576000001)
Ser Asp Met Asp
C16H26N4O10S (466.1369576000001)
Ser Glu Cys Glu
C16H26N4O10S (466.1369576000001)
Ser Glu Glu Cys
C16H26N4O10S (466.1369576000001)
Ser Met Asp Asp
C16H26N4O10S (466.1369576000001)
Thr Cys Asp Glu
C16H26N4O10S (466.1369576000001)
Thr Cys Glu Asp
C16H26N4O10S (466.1369576000001)
Thr Asp Cys Glu
C16H26N4O10S (466.1369576000001)
Thr Asp Glu Cys
C16H26N4O10S (466.1369576000001)
Thr Glu Cys Asp
C16H26N4O10S (466.1369576000001)
Thr Glu Asp Cys
C16H26N4O10S (466.1369576000001)
Val Cys Asp Met
Val Cys Met Asp
Val Asp Cys Met
Val Asp Met Cys
Val Met Cys Asp
Val Met Asp Cys
Spirapril
C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
hesperetin-7-O-glucuronide
Melledonal B
C23H27ClO8 (466.13943720000003)
Glucodistylin
Epicatechin 3'-O-glucuronide
Epicatechin 7-O-glucuronide
Ziprasidone Hydrochloride Monohydrate
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 > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists 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 Ziprasidone (CP-88059) hydrochloride monohydrate is an orally active combined 5-HT and dopamine receptor antagonist[1]. Ziprasidone hydrochloride monohydrate has affinities for Rat D2 (Ki=4.8 nM), 5-HT2A (Ki=0.42 nM) and 5-HT1A (Ki=3.4 nM)[1].
Varlitinib
C22H19ClN6O2S (466.09786640000004)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
2-METHANESULFONYL-5-(TRIFLUOROMETHYL)-1,3,4-THIADIAZOLE
C23H22N4O5S (466.13108420000003)
(1s,4s)-(+)-2-naphthalen-2-ylmethyl-2,5-diaza-bicyclo[2.2.1]heptane 2cf3cooh
5-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonylthiophen-3-yl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one
C19H26N6O4S2 (466.14568760000003)
N,N-bis(2-methylpropyl)carbamodithioate,nickel(2+)
C18H36N2NiS4 (466.11146859999997)
2-hydroxy-5-(1,1,3,3-tetramethylbutyl)phenylmercury acetate
C16H24HgO3 (466.1431673999999)
6-bromo-2-[4-(diethylamino)phenyl]-1-ethylbenz[cd]indolium acetate
2-Chloro-5-{[(3,4,5-triethoxybenzoyl)carbamothioyl]amino}benzoic acid
C21H23ClN2O6S (466.09652880000004)
2-Iodo-3,6-dimethoxy-2,4,6-tri-i-propyl-1,1-biphenyl
C23H31IO2 (466.13686959999995)
1(2H)-Isoquinolinone, 5,8-dichloro-2-((1,2-dihydro-4-methoxy-6-methyl-2-oxo-3-pyridinyl)methyl)-3,4-dihydro-7-((R)-methoxy-3-oxetanylmethyl)-
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C156804 - EZH2 Inhibitor
(4-Chlorophenyl) 6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
C25H20Cl2N2O3 (466.08509100000003)
C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C93259 - VEGFR Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163953 - VEGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor
Ternstroside A
C22H26O11 (466.14750460000005)
A beta-D-glucoside with 2-(3,4-dihydroxyphenyl)ethoxy residue at the anomeric position and a [(3,4-dihydroxyphenyl)acetyl]oxy residue at position 2. Isolated from Ternstroemia japonica, it exhibits antioxidant activity.
Ternstroside C
C22H26O11 (466.14750460000005)
A beta-D-glucoside with 2-(3,4-dihydroxyphenyl)ethoxy residue at the anomeric position and a [(3,4-dihydroxyphenyl)acetyl]oxy residue at position 3. Isolated from Ternstroemia japonica, it exhibits antioxidant activity.
Ternstroside D
C22H26O11 (466.14750460000005)
A beta-D-glucoside with 2-(3,4-dihydroxyphenyl)ethoxy residue at the anomeric position and a [(3,4-dihydroxyphenyl)acetyl]oxy residue at position 6. Isolated from Ternstroemia japonica, it exhibits antioxidant activity.
4-O-methylrobinetinidol 3-O-beta-D-glucopyranoside
C22H26O11 (466.14750460000005)
A monosaccharide derivative that is 4-O-methylrobinetinidol attached to a beta-D-glucopyranosyl residue at position 3. Isolated from Acacia mearnsii, it exhibits inhibitory activity against alpha-amylase.
4-[(2S)-2-hydroxy-3-methyl-3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]butoxy]-7-furo[3,2-g][1]benzopyranone
C22H26O11 (466.14750460000005)
3-(1,3-Benzothiazol-2-YL)-2-(1,4-dioxo-1,2,3,4-tetrahydrophthalazin-6-YL)-5-[(E)-2-phenylvinyl]-3H-tetraazol-2-ium
Esaxerenone
C22H21F3N2O4S (466.11740620000006)
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent
3-[[4-(4-Fluorophenoxy)benzenesulfonyl]-(1-hydroxycarbamoylcyclopentyl)amino]propionic acid
[(1aS)-6alpha-Benzoyloxy-1a,1balpha,2,5aalpha,6,6abeta-hexahydro-1a-hydroxymethyloxireno[4,5]cyclopenta[1,2-c]pyran-2alpha-yl]beta-D-glucopyranoside
C22H26O11 (466.14750460000005)
N-[4-(Trifluoromethyl)phenyl]-N-[1-[5-(Trifluoromethyl)pyridin-2-Yl]piperidin-4-Yl]pyridin-3-Amine
C23H20F6N4 (466.15920719999997)
(-)-Epicatechin 3'-O-glucuronide
(-)-Epicatechin 3-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
S-[(1R,2R)-1-(2-chlorophenyl)-2-(4-fluorophenyl)-1,3-dihydroxy-3-(1H-1,2,4-triazol-1-yl)propan-2-yl]-L-cysteine
C20H20ClFN4O4S (466.08777620000006)
1-(3,4-dihydroxyphenyl)-3-[2,4,6-trihydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]propane-1,3-dione
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-N-hydroxy-C-(5-methylsulfanylpentyl)carbonimidoyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
N-[[1-(beta-D-Glucopyranosyl)-1H-indole-3-yl]acetyl]-L-glutamic acid
(2S,3S,4S,5R)-6-[[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
5-{2-[4-(1,2-benzisothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one hydrochloride hydrate
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 > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants
Chaetoviridin I
C23H27ClO8 (466.13943720000003)
An azaphilone found in Chaetomium globosum.
6-(3-cyclopentyloxy-4-methoxyphenyl)-3-(2,5-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
C24H26N4O4S (466.16746760000007)
Saccharumoside B
C22H26O11 (466.14750460000005)
A natural product found in Acer saccharum.
N-[(4-chlorophenyl)methyl]-2-[(1S,4S,6E,12R)-3,10-dioxo-2-oxa-11-azatricyclo[10.7.0.013,18]nonadeca-6,13,15,17-tetraen-4-yl]acetamide
C26H27ClN2O4 (466.16592520000006)
2,3-bis(2-furanyl)-N-[4-(4-morpholinyl)phenyl]-6-quinoxalinecarboxamide
5-(2-furanyl)-N-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxamide
C23H17F3N6O2 (466.13650179999996)
2-(4-benzoylphenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
C25H26N2O5S (466.15623460000006)
4-(Difluoromethoxy)benzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
5-O-[(S)-[(2-Aminobenzoyl)oxy](Hydroxy)phosphoryl]adenosine
N-[[5-(1H-benzimidazol-2-yl)-2-chloroanilino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide
C23H19ClN4O3S (466.0866334000001)
N-[2-[[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-2-furancarboxamide
C24H26N4O4S (466.16746760000007)
2-(1,3-dimethyl-2,6-dioxo-9-purinyl)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]acetamide
N-[9-(2-carboxyethyl)-6-(ethylamino)-2,7-dimethyl-3H-xanthen-3-ylidene]ethanaminium perchlorate
C22H27ClN2O7 (466.15067020000004)
N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-2-(4-morpholinyl)-9-(3-thiophenyl)-6-purinamine
C21H19ClN8OS (466.10909940000005)
gammaGluCys(4MeOI3M)Gly
C20H26N4O7S (466.15221260000004)
A tripeptide that is glutathione in which the side-chain thiol group of the cysteine residue is substituted by a 4-methoxyindol-3-ylmethyl group.
[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl (1S)-1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate
C22H26O11 (466.14750460000005)
[3-Acetyl-2-methyl-1-(4-methylphenyl)indol-5-yl] 2-(1,3-dioxoisoindol-2-yl)acetate
4-[2-Hydroxy-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]furo[3,2-g]chromen-7-one
C22H26O11 (466.14750460000005)
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
N-[(3-fluorophenyl)methyl]-2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]oxan-2-yl]acetamide
C22H27FN2O6S (466.15737740000003)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]acetic acid
N-[(3-fluorophenyl)methyl]-2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]oxan-2-yl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(3-fluorophenyl)methyl]-2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(3-fluorophenyl)methyl]-2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]acetic acid
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]acetic acid
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[4-(trifluoromethyl)phenyl]carbamoylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]acetic acid
N-[(3-fluorophenyl)methyl]-2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(3-fluorophenyl)methyl]-2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(3-fluorophenyl)methyl]-2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(3-fluorophenyl)methyl]-2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
N-[(2-fluorophenyl)methyl]-2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(4-methoxyphenyl)sulfonylamino]-2-oxanyl]acetamide
C22H27FN2O6S (466.15737740000003)
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
6-[3,5-Dihydroxy-4-[2-hydroxy-3-(3-methoxyphenyl)propyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
C22H26O11 (466.14750460000005)
3-(4-Hydroxy-3-methoxyphenyl)-1-[2,4,6-trihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]propan-1-one
C22H26O11 (466.14750460000005)
3,4,5-Trihydroxy-6-[4-[3-oxo-3-(2,3,4,6-tetrahydroxyphenyl)propyl]phenoxy]oxane-2-carboxylic acid
4-[4-[(5Z)-5-[(Z)-2-Methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
4-(2,8-Dimethylimidazo[1,2-a]pyridine-3-carbonyl)-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
C24H26N4O4S (466.16746760000007)
L-gamma-glutamyl-S-[N-hydroxy-6-(methylsulfanyl)hexanimidoyl]-L-cysteinylglycine
3,4,5-Trihydroxy-2-[hydroxy(3,4,5-trihydroxyoxan-2-yl)methyl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-2,5-dien-1-one
(3S,4aS,5S)-6-chloro-3-(dimethylamino)-1,5,9,10,11a-pentahydroxy-5-methyl-2,11-dioxo-3,3a,4,4a-tetrahydrocyclopenta[b]anthracene-1-carboxamide
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 4-aminobenzoate
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one
4-[(2S,3R,4S,5S,6R)-6-[(3,4-dihydroxybenzoyl)oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-methoxybenzoic acid
(2S,3S)-3,5,7-trihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
S-(6-methylthiohexylhydroximoyl)glutathione
An S-substituted glutathione in which the thiol hydrogen of glutathoine has been replaced by a 6-methylthiohexylhydroximoyl group.
Quercetin 7-O-beta-D-glucoside
A quercetin O-glucoside in which a glucosyl residue is attached at position 7 of quercetin via a beta-glycosidic linkage.
(2r,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one
1-(2,6-dihydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-(3-hydroxy-4-methoxyphenyl)propan-1-one
C22H26O11 (466.14750460000005)
3-hydroxy-2-(2-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoyl)-5-(hydroxymethyl)benzoic acid
(2-hydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2,6-dimethoxybenzoate
C22H26O11 (466.14750460000005)
(2s)-2-amino-4-{[(1r)-1-(carboxymethyl-c-hydroxycarbonimidoyl)-2-{[(4-methoxy-1h-indol-3-yl)methyl]sulfanyl}ethyl]-c-hydroxycarbonimidoyl}butanoic acid
C20H26N4O7S (466.15221260000004)
[(1s,4ar,5s,7as)-5-hydroxy-1-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate
C22H26O11 (466.14750460000005)
2-{[2-({[2-(6-chloro-4-hydroxy-1-methylindol-3-yl)-4-methyl-5h-1,3-oxazol-4-yl](hydroxy)methylidene}amino)-1-hydroxypropylidene]amino}-3-hydroxypropanoic acid
6,8-dihydroxy-3-methyl-1-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]tetraphene-7,12-dione
4,6,12-trihydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-1(16),2,4,6,10(17),11,13-heptaen-9-one
[(2s,4s,5s,10s)-5-hydroxy-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-2-yl]methyl benzoate
C22H26O11 (466.14750460000005)
(2r)-5,7-dihydroxy-2-[(2s,3s)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-4-yl]-2,3-dihydro-1-benzopyran-4-one
5-(2,5-dihydroxy-4-{3-[hydroxy(phenyl)methyl]oxiran-2-yl}-3-methoxyphenoxy)-6-(hydroxymethyl)oxane-2,3,4-triol
C22H26O11 (466.14750460000005)
methyl (5e)-7-[(1e,2r)-2-(acetyloxy)-4-bromo-2-[(2z)-oct-2-en-1-yl]-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate
(2s,3r,4s,5s,6r)-2-{[(2r,3s)-3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C22H26O11 (466.14750460000005)
(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one
18-methoxy-13,14-dimethyl-19,20-dioxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,15,17-pentaen-12-yl 2-methylbut-2-enoate
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)ethoxy]oxan-2-yl]methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate
C22H26O11 (466.14750460000005)
(2r,3r)-3-ethyl-7,9-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-2,3-dihydro-1,4,5-trioxatetraphen-10-one
2-{[3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C22H26O11 (466.14750460000005)
2-[5-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)-3-hydroxy-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C22H26O11 (466.14750460000005)
2-(4-hydroxy-3-methoxyphenyl)-3,7,12-trimethoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
(2r,2as,4ar,7r,7as,7br)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-1h,2h,5h,7h,7ah-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate
C23H27ClO8 (466.13943720000003)
[(1s,4ar,5r,7ar)-4a,5-dihydroxy-1-{[(2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-7-yl]methyl benzoate
C22H26O11 (466.14750460000005)
1-{2,4-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-methyloxan-2-yl]phenyl}-3-(3,4-dihydroxyphenyl)-2-hydroxypropan-1-one
C22H26O11 (466.14750460000005)
9-[(2r)-3-hydroxy-3-methyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butoxy]furo[3,2-g]chromen-7-one
C22H26O11 (466.14750460000005)
(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3,7,12-trimethoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
4-({4'-hydroxy-3-[2-(4-hydroxyphenyl)ethynyl]-[1,1'-biphenyl]-2-yl}(phenyl)methylidene)cyclohexa-2,5-dien-1-one
(2s)-2-{[(2r)-2-({[(4r)-2-(6-chloro-4-hydroxy-1-methylindol-3-yl)-4-methyl-5h-1,3-oxazol-4-yl](hydroxy)methylidene}amino)-1-hydroxypropylidene]amino}-3-hydroxypropanoic acid
3-hydroxy-2,5-dimethylphenyl 3-(2,4-dihydroxy-3,6-dimethylbenzoyloxy)-6-hydroxy-2,4-dimethylbenzoate
(2s)-5,7-dihydroxy-2-[(2r,3r)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-4-yl]-2,3-dihydro-1-benzopyran-4-one
2-hydroxy-5-({3,4,5-trihydroxy-6-[(4-hydroxy-3-methoxybenzoyloxy)methyl]oxan-2-yl}oxy)benzoic acid
(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 3-hydroxy-2,6-dimethoxybenzoate
C22H26O11 (466.14750460000005)
[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-2-yl]methyl benzoate
C22H26O11 (466.14750460000005)