Exact Mass: 450.1240798

Exact Mass Matches: 450.1240798

Found 500 metabolites which its exact mass value is equals to given mass value 450.1240798, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Astilbin

(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Astilbin is a flavanone glycoside that is (+)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage. It has a role as a radical scavenger, an anti-inflammatory agent and a plant metabolite. It is an alpha-L-rhamnoside, a member of 3-hydroxyflavanones, a tetrahydroxyflavanone, a flavanone glycoside, a monosaccharide derivative and a member of 4-hydroxyflavanones. It is functionally related to a (+)-taxifolin. It is an enantiomer of a neoastilbin. Astilbin is a natural product found in Smilax corbularia, Rhododendron simsii, and other organisms with data available. Astilbin is a metabolite found in or produced by Saccharomyces cerevisiae. Astilbin is found in alcoholic beverages. Astilbin is a constituent of Vitis vinifera (wine grape).Astilbin is a flavanonol, a type of flavonoid. It can be found in St Johns wort (Hypericum perforatum, Clusiaceae, subfamily Hypericoideae, formerly often considered a full family Hypericaceae), in Dimorphandra mollis (Fava danta, Fabaceae), in the the leaves of Harungana madagascariensis (Hypericaceae), in the rhizome of Astilbe thunbergii, in the root of Astilbe odontophylla(Saxifragaceae) and in the rhizone of Smilax glabra (Chinaroot, Smilacaceae). A flavanone glycoside that is (+)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage. Constituent of Vitis vinifera (wine grape) Astilbin is a flavonoid compound and enhances NRF2 activation. Astilbin also suppresses TNF-α expression and NF-κB activation. Astilbin is a flavonoid compound and enhances NRF2 activation. Astilbin also suppresses TNF-α expression and NF-κB activation. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3].

Astilbin

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

Neoastilbin is a flavanone glycoside that is (-)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage. It is an alpha-L-rhamnoside, a member of 3-hydroxyflavanones, a tetrahydroxyflavanone, a monosaccharide derivative, a flavanone glycoside and a member of 4-hydroxyflavanones. It is functionally related to a (-)-taxifolin. It is an enantiomer of an astilbin. Neoastilbin is a natural product found in Neolitsea sericea, Dimorphandra mollis, and other organisms with data available. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1]. Neosmitilbin is?isolated from?Garcinia?mangostana. Neosmitilbin is?isolated from?Garcinia?mangostana.

Auriculoside

7,3,5-Trihydroxy-4-methoxyflavan 3-O-glucoside

C22H26O10 (450.15258960000006)

A flavan glycoside that is (2S)-flavan substituted by a methoxy group at position 4, hydroxy groups at positions 7 and 5 and a beta-D-glucopyranosyloxy group at position 3 respectively.

Exserohilone

(-)-Exserohilone

C20H22N2O6S2 (450.0919232)

PHC 4-O-glucoside

2,3,4,4,6-Pentahydroxychalcone 4-O-beta-D-glucoside

C21H22O11 (450.11620619999997)

Neocarthamin

6,7-dihydroxy-2-(4-hydroxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Constituent of the flowers of Carthamus tinctorius (safflower). Carthamidin 5-glucoside is found in safflower, fats and oils, and herbs and spices. Neocarthamin is found in fats and oils. Neocarthamin is a constituent of the flowers of Carthamus tinctorius (safflower).

Empagliflozin

Empagliflozin (BI 10773)

C23H27ClO7 (450.14452220000004)

A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BK - Sodium-glucose co-transporter 2 (sglt2) inhibitors C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent D007004 - Hypoglycemic Agents > D000077203 - Sodium-Glucose Transporter 2 Inhibitors COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C98083 - SGLT2 Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

ISRIB

C22H24Cl2N2O4 (450.1113044)

Miscanthoside

2-(3,4-dihydroxyphenyl)-5-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Constituent of Pyrus communis (pear) and Mentha aquatica (water mint),. Eriodictyol 7-glucoside is found in many foods, some of which are pomes, orange mint, peppermint, and tea. Miscanthoside is found in orange mint. Miscanthoside is a constituent of Pyrus communis (pear) and Mentha aquatica (water mint), Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1]. Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1].

Melleolide L

3-Formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1H,2H,2ah,4ah,5H,6H,7H,7ah,7BH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoic acid

C23H27ClO7 (450.14452220000004)

Melleolide L is found in mushrooms. Melleolide L is a metabolite of Armillariella mellea (honey mushroom Metabolite of Armillariella mellea (honey mushroom). Melleolide L is found in mushrooms.

Maesopsin 6-glucoside

2,4-dihydroxy-2-[(4-hydroxyphenyl)methyl]-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-3-one

C21H22O11 (450.11620619999997)

Maesopsin 6-glucoside is found in tea. Maesopsin 6-glucoside is a constituent of Ceanothus americanus (New Jersey tea)

Phloretin 2'-O-glucuronide

(2S,3S,4S,5R,6S)-6-{3,5-dihydroxy-2-[3-(4-hydroxyphenyl)propanoyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C21H22O11 (450.11620619999997)

Phloretin 2-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313). Phloretin glucuronide is a biomarker for the consumption of apples

4-androsten-3beta,17beta-diol disulfate

[(1S,2R,5S,10R,11S,14S,15S)-2,15-dimethyl-5-(sulfooxy)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl]oxidanesulfonic acid

C19H30O8S2 (450.138202)

4-Androsten-3beta,17beta-diol disulfate, also known as 4-androsten-3β,17β-diol disulfate, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 4-Androsten-3beta,17beta-diol disulfate is considered to be a practically insoluble (in water) and an extremely strong acidic compound. Human plasma levels of 4-androsten-3beta,17beta-diol disulfate were reported to be influenced by genetic variants in the gene SULT2A1 which codes for the enzyme dehydroepiandrosterone sulfotransferase (PMID: 24816252).

Neoisoastilbin

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1].

Cyanidin-3-o-beta-glucopyranoside

2-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2H-chromen-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H22O11 (450.11620619999997)

Empagliflozin

2-(4-chloro-3-{[4-(oxolan-3-yloxy)phenyl]methyl}phenyl)-6-(hydroxymethyl)oxane-3,4,5-triol

C23H27ClO7 (450.14452220000004)

Isrib

2-(4-Chlorophenoxy)-N-(4-{[2-(4-chlorophenoxy)-1-hydroxyethylidene]amino}cyclohexyl)ethanimidate

C22H24Cl2N2O4 (450.1113044)

Marein

1-(2,3-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one

C21H22O11 (450.11620619999997)

N-(2-((6-Chloro-3-(3-(N,N-dimethylsulfamoyl)phenyl)-2-methylimidazo[1,2-b]pyridazin-8-yl)amino)ethyl)acetamide

N-[2-({6-chloro-3-[3-(dimethylsulphamoyl)phenyl]-2-methylimidazo[1,2-b]pyridazin-8-yl}amino)ethyl]ethanimidic acid

C19H23ClN6O3S (450.1240798)

Suvorexant

5-chloro-2-{5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl}-1,3-benzoxazole

C23H23ClN6O2 (450.1570928)

Aromadendrin 3-galactoside

5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Aromadendrin 3-galactoside 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. Aromadendrin 3-galactoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Aromadendrin 3-galactoside can be found in common buckwheat, which makes aromadendrin 3-galactoside a potential biomarker for the consumption of this food product.

Eriodictyol-6-C-glucoside

(2R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Eriodictyol-8-C-glucoside

(2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Taxifolin 7-rhamnoside

3,5,7,3,4-Pentahydroxyflavanone 7-rhamnoside

C21H22O11 (450.11620619999997)

Taxifolin 7-O-rhamnoside (Taxifolin 7-O-α-L-rhamnoside) is a flavonoid isolated from Hypericum japonicum.

Taxifolin

(2R,3R)-2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-7-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)chroman-4-one

C21H22O11 (450.11620619999997)

Taxifolin 7-O-rhamnoside is a natural product found in Hypericum japonicum with data available. Taxifolin 7-O-rhamnoside (Taxifolin 7-O-α-L-rhamnoside) is a flavonoid isolated from Hypericum japonicum.

4-Methoxyphlorizin

2,4,6-Trihydroxy-4-methoxydihydrochalcone 2-O-glucoside

C22H26O10 (450.15258960000006)

Isookaninglucoside

7,8,3,4-Tetrahydroxyflavanone 7-O-glucoside

C21H22O11 (450.11620619999997)

Flavanomarein is a predominant flavonoid of Coreopsis tinctoria Nutt with protective effects against diabetic nephropathy. Flavanomarein has good antioxidative, antidiabetic, antihypertensive and anti-hyperlipidemic activities[1][2].

Marein

(E)-1-(2,3-dihydroxy-4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)phenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one

C21H22O11 (450.11620619999997)

Marein is a member of flavonoids and a glycoside. Marein is a natural product found in Lasthenia californica, Viguiera dentata, and other organisms with data available. Acquisition and generation of the data is financially supported in part by CREST/JST. Marein has the neuroprotective effect due to a reduction of damage to mitochondria function and activation of the AMPK signal pathway. Marein improves insulin resistance induced by high glucose in HepG2 cells through CaMKK/AMPK/GLUT1 to promote glucose uptake, through IRS/Akt/GSK-3β to increase glycogen synthesis, and through Akt/FoxO1 to decrease gluconeogenesis. Marein is a HDAC inhibitor with an IC50 of 100 μM. Marein has beneficial antioxidative, antihypertensive, antihyperlipidemic and antidiabetic effects[1][2][3]. Marein has the neuroprotective effect due to a reduction of damage to mitochondria function and activation of the AMPK signal pathway. Marein improves insulin resistance induced by high glucose in HepG2 cells through CaMKK/AMPK/GLUT1 to promote glucose uptake, through IRS/Akt/GSK-3β to increase glycogen synthesis, and through Akt/FoxO1 to decrease gluconeogenesis. Marein is a HDAC inhibitor with an IC50 of 100 μM. Marein has beneficial antioxidative, antihypertensive, antihyperlipidemic and antidiabetic effects[1][2][3].

Aromadendrin 6-C-glucoside

(2R,3R) -6-beta-D-Glucopyranosyl-2,3-dihydro-3,5,7-trihydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

Melampyroside

C22H26O10 (450.15258960000006)

MEGxp0_000241

C21H22O11 (450.11620619999997)

Okanin 3-glucoside

3,4,2,3,4-Pentahydroxychalcone 3-glucoside

C21H22O11 (450.11620619999997)

(2R)-5,7,3,4-Tetrahydroxyflavanone 6-C-glucoside

C21H22O11 (450.11620619999997)

Stillopsin

3,4,2,4,5-Pentahydroxychalcone 4-glucoside

C21H22O11 (450.11620619999997)

Asebotin

1- [ 2- (beta-D-Glucopyranosyloxy) -6-hydroxy-4-methoxyphenyl ] -3- (4-hydroxyphenyl) -1-propanone

C22H26O10 (450.15258960000006)

8-C-Glucopyranosyleriodictyol

5,7,3,4-Tetrahydroxyflavanone 8-C-glucopyranoside

C21H22O11 (450.11620619999997)

Isocarthamidin 8-glucoside

5,7,8,4-Tetrahydroxyflavanone 8-glucoside

C21H22O11 (450.11620619999997)

Aromadendrin 3-galactoside

3,5,7,4-Tetrahydroxyflavanone 3-galactoside

C21H22O11 (450.11620619999997)

Methylinoscavin B

(-)-Methylinoscavin B

C25H22O8 (450.1314612)

Myxopyroside

C18H26O13 (450.13733460000003)

Coccinoside B

(2S)-5,7,2,5-Tetrahydroxyflavonone 7-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

Hovetrichoside C

2,4,6,4-Tetrahydroxy-2-benzylcoumaranone 4-O-glucoside

C21H22O11 (450.11620619999997)

Rumejaposide D

C21H22O11 (450.11620619999997)

Aromadendrin 4-glucoside

3,5,7,4-Tetrahydroxyflavanone 4-glucoside

C21H22O11 (450.11620619999997)

Stepposide

5,7,2,4-Tetrahydroxyflavanone 7-O-glucoside

C21H22O11 (450.11620619999997)

3-Chloro-9beta-hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-dehydroleucodin

C22H23ClO8 (450.1081388)

Epoxyexserohilone

C20H22N2O6S2 (450.0919232)

2,5,7,4-Tetrahydroxyflavanone 7-glucoside

C21H22O11 (450.11620619999997)

Dihydrorhamnetin 3-O-beta-D-arabinopyranoside

(2R) -3,4,5-Trihydroxy-3beta- (beta-D-arabinopyranosyloxy) -7-methoxyflavanone

C21H22O11 (450.11620619999997)

Steppogenin 4-O-beta-D-glucoside

5,7,2,4-Tetrahydroxyflavanone 4-glucoside

C21H22O11 (450.11620619999997)

Dalbergioidin 4-O-beta-D-glucopyranoside

5,7,2,4-Tetrahydroxyisoflavanone 4-O-glucoside

C21H22O11 (450.11620619999997)

Helicioside A

C21H22O11 (450.11620619999997)

Forsythenside A

C22H26O10 (450.15258960000006)

Macrocarposide

C21H22O11 (450.11620619999997)

Fustin 3-glucoside

3,7,3,4-Tetrahydroxyflavanone 3-glucoside

C21H22O11 (450.11620619999997)

8-C-Glucosyldihydrokaempferol

3,5,7,4-Tetrahydroxyflavanone 8-C-glucoside

C21H22O11 (450.11620619999997)

Nikkomycin Wz

C19H22N4O9 (450.1386722)

Nikkomycin Wx

C19H22N4O9 (450.1386722)

Vittarin C

C22H26O10 (450.15258960000006)

gaboroquinone B

C24H18O9 (450.0950778)

6-Chloro-10alpha-hydroxymelleolide

C23H27ClO7 (450.14452220000004)

Tephrodin

(8aR,11aR) -rel- (-) -11a- (Acetyloxy) -8a,11a-dihydro-5-methoxy-10,10-dimethyl-2-phenyl-4H,8H-furo [ 3,2-d ] benzo [ 1,2-b:3,4-b ] dipyran-4,11 (10H) -dione

C25H22O8 (450.1314612)

(2S)-5,7,3,4-Tetrahydroxyflavanone 6-C-glucoside

C21H22O11 (450.11620619999997)

Smitilbin

(2R,3S) -3,5,7,3,5-Pentahydroxyflavanone 3-rhamnoside

C21H22O11 (450.11620619999997)

Neosmitilbin

(2S,3S) -3,5,7,3,5-Pentahydroxyflavanone 3-rhamnoside

C21H22O11 (450.11620619999997)

Carthamidin 5-glucoside

5,6,7,4-Tetrahydroxyflavanone 5-O-glucoside

C21H22O11 (450.11620619999997)

Aromadendrin 3-glucoside

C21H22O11 (450.11620619999997)

12beta-hydroxychaetoviridin C

C23H27ClO7 (450.14452220000004)

An azaphilone that is the 12beta-hydroxy derivative of chaetoviridin C. It has been isolated from Chaetomium globosum.

Isoastibin

(2R,3S) -3,5,7,3,4-Pentahydroxyflavanone 3-rhamnoside

C21H22O11 (450.11620619999997)

Neoastilbin

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-4-chromanone

C21H22O11 (450.11620619999997)

Astilbin

(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chroman-4-one

C21H22O11 (450.11620619999997)

Neoisoastilbin is a natural product found in Smilax corbularia, Neolitsea sericea, and other organisms with data available. Astilbin is a flavonoid compound and enhances NRF2 activation. Astilbin also suppresses TNF-α expression and NF-κB activation. Astilbin is a flavonoid compound and enhances NRF2 activation. Astilbin also suppresses TNF-α expression and NF-κB activation. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Isoastilbin is a dihydroflavonol glycoside compound in Rhizoma Smilacis glabrae and Astragalus membranaceus. Isoastilbin inhibits glucosyltransferase (GTase) with an IC50 value of 54.3 μg/mL, and also inhibits tyrosinase activity. Isoastilbin shows neuroprotective, antioxidation, antimicrobial and anti-apoptotic properties and has the potential for Alzheimer’s disease research[1][21][3]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1].

Miscanthoside

(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

Eriodictyol 7-O-beta-D-glucopyranoside is a flavanone glycoside that is eriodictyol attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It is an Nrf2 activator and provides protection against cisplatin-induced toxicity. It has a role as a plant metabolite and a radical scavenger. It is a monosaccharide derivative, a beta-D-glucoside, a flavanone glycoside and a trihydroxyflavanone. It is functionally related to an eriodictyol. Eriodictyol-7-O-glucoside is a natural product found in Lysimachia maxima, Balanophora tobiracola, and other organisms with data available. Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1]. Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1].

Maesopsin 6-beta-D-glucopyranoside

2,4,6,4-Tetrahydroxy-2-benzylcoumaranone 6-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

neoisoastilbin

(2S,3R) -3,5,7,3,4-Pentahydroxyflavanone 3-rhamnoside

C21H22O11 (450.11620619999997)

Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1]. Neoisoastilbin possesses antioxidant, anti-hyperuricemic and anti-Inflammatory activities[1].

Sinensin

3,5,7,4-Tetrahydroxyflavanone 7-glucoside

C21H22O11 (450.11620619999997)

ACon1_002430

C20H22N2O10 (450.1274392)

Oprea1_013559

C24H23ClN4OS (450.1281018)

Okanin-4-O-glucoside

C21H22O11 (450.11620619999997)

Annotation level-1

EP_M451

C20H20ClFN4O3S (450.0928612)

CONFIDENCE Transformation product, tentative ID (Level 2b); INTERNAL_ID 2203

IRIGENIN, 7-BENZYL ETHER

C25H22O8 (450.1314612)

8-desacyl enhydrin-(2,3-epoxyisobutyrate)|8-desacyl enhydrin-<2,3-epoxyisobutyrate>

C22H26O10 (450.15258960000006)

HMS3347F15

C21H22O11 (450.11620619999997)

vanilloyl-beta-D-(2-O-p-hydroxybenzoyl)glucoside

C21H22O11 (450.11620619999997)

(2S)-5,7,3,5-tetrahydroxy-flavanone 7-O-beta-D-glucopyranoside|(2S)-5,7,3,5-tetrahydroxyflavanone 7-O-beta-D-glucopyranoside|(2S)-5,7,3?,5?-tetrahydroxyflavanone 7-O-beta-D-glucopyranoside|(S)-5,7,3,5-tetrahydroxyflavanone-7-O-beta-D-glucopyranose|huazhongilexone-7-O-beta-D-glucopyranoside

(2S)-5,7,3,5-tetrahydroxy-flavanone 7-O-beta-D-glucopyranoside|(2S)-5,7,3,5-tetrahydroxyflavanone 7-O-beta-D-glucopyranoside|(2S)-5,7,3?,5?-tetrahydroxyflavanone 7-O-beta-D-glucopyranoside|(S)-5,7,3,5-tetrahydroxyflavanone-7-O-beta-D-glucopyranose|huazhongilexone-7-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

C22H26O10

C22H26O10 (450.15258960000006)

aceronidin|leucocyanidin-3-O-beta-D-glucoside

C21H22O11 (450.11620619999997)

4-O-beta-D-glucopyranosyl protoapigenin|protoapigenin 4-O-beta-D-glucoside|protoapigenin-4-glucoside

C21H22O11 (450.11620619999997)

(2S)-naringenin 4-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

Alliarosid (8-Hexityl-apigenin)

C21H22O11 (450.11620619999997)

aloesaponol IV 8-O-beta-D-glucoside

C22H26O10 (450.15258960000006)

CHEMBL4174340

C25H22O8 (450.1314612)

1-glucosyloxy-3-hydroxy-5,8-dimethoxyxanthone

C21H22O11 (450.11620619999997)

Angeladin

C25H22O8 (450.1314612)

glochicoccin B|methyl (2S,3aR,4S,4S,5R,6S,7aR)-decahydro-3a,4-dihydroxy-4-[(4-hydroxybenzoyl)oxy]-5-methyl-3-oxo-3H-spiro[1-benzofuran-2,2-pyran]-6-carboxylate

C22H26O10 (450.15258960000006)

1-hydroxy-2,7-dimethoxy-3-O-beta-D-glucopyranosylxanthone

C21H22O11 (450.11620619999997)

7-hydroxy-1,4-dimethoxy-2-O-beta-D-glucopyranosylxanthone|prunifloroside B

C21H22O11 (450.11620619999997)

2-methoxy-4,6-dihydroxy-alpha-chalcanol-alpha,beta-epoxide-4-O-beta-D-glucopyranoside|trifochalcanoloside I

C22H26O10 (450.15258960000006)

Eriodictyol C-hexoside

C21H22O11 (450.11620619999997)

(5R,6R,7S,8S,9R*)-14-acetoxy-3-chloro-9-hydroxy-2-oxo-8-tigloxyguia-1(10)3-dien-6,12-olide

(5R*,6R*,7S*,8S*,9R*)-14-acetoxy-3-chloro-9-hydroxy-2-oxo-8-tigloxyguia-1(10)3-dien-6,12-olide

C22H23ClO8 (450.1081388)

1-Glucosyl-gentiacaulein|1-O-beta-D-glucopyranoside-7-hydroxyl-3,8-dimethoxyxanthone|7-hydroxy-3,8-dimethoxyxanthone-1-O-beta-D-glucopyranoside|gentiacaulein-1-O-D-glucoside

C21H22O11 (450.11620619999997)

(S)-naproxen beta-1-O-acyl glucuronide

C21H22O11 (450.11620619999997)

(2-Hydroxymethyl-phenyl)-(O6-veratroyl-beta-D-glucopyranosid)|(2-hydroxymethyl-phenyl)-(O6-veratroyl-beta-D-glucopyranoside)|2-(O6-Veratroyl-beta-D-glucopyranosyloxy)-benzylalkohol|Glycosmin

C22H26O10 (450.15258960000006)

peyssonoic acid A

C23H31BrO4 (450.1405586)

2-O-alpha-L-3-acetylarabinofuranosyl-3,5,6-trihydroxy-4-methoxybenzophenone|3-acetylannulatophenonoside|acetylannulatophenonoside

C21H22O11 (450.11620619999997)

chaetomugilin M

C23H27ClO7 (450.14452220000004)

(2S,3R)-3,10-dimethoxy-9-O-(6-methoxy-2-hydroxymethyldihydrobenzofuran-3-yl)-dibenz--pyran-6-one

C25H22O8 (450.1314612)

2,2,3,3,7,7-Hexahydroxy-1,1-biphenanthrene

C28H18O6 (450.1103328)

8-(2-hydroxybenzyl-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,7-dimethoxy-4H-chromen-4-one|8-C-(o-hydroxybenzyl)pachypodol|miliufavol

C25H22O8 (450.1314612)

5-O-(2-beta-D-glucopyranosyl)eriodictyol

C21H22O11 (450.11620619999997)

Dibenzoyl-alpha-Gardiol

C25H22O8 (450.1314612)

3,5-Di-Me ether,8-O-beta-D-glucopyranoisde-Bellidin

C21H22O11 (450.11620619999997)

3-oxo-10alphaH-stilpnotomentolide-8-O-(5-hydroxysenecioate)|3-oxo-10alphaH-stilpnotomentolide-8-O-<5-hydroxysenecioate>

C22H26O10 (450.15258960000006)

Veratriloside

C21H22O11 (450.11620619999997)

curculigoside G

C22H26O10 (450.15258960000006)

5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chroman-4-one

C21H22O11 (450.11620619999997)

TW-95a

C24H18O9 (450.0950778)

Villinol

C25H22O8 (450.1314612)

dunalianoside B

C21H22O11 (450.11620619999997)

dihydrokaempferol-7-O-glucoside

C21H22O11 (450.11620619999997)

Carthamin

C21H22O11 (450.11620619999997)

benzyl 2-beta-O-D-glucopyranosyl-3,6-dimethoxybenzoate

C22H26O10 (450.15258960000006)

1,3-Dihydroxy-4,5-dimethoxyxanthone-1-O-??-D-glucopyranoside

C21H22O11 (450.11620619999997)

aspergillazine B|aspergillazine C

C20H22N2O8S (450.1096812)

2-(4-hydroxyphenyl)ethyl 2-O-(3,4-dihydroxyphenylethanoyl)-beta-D-glucopyranoside|ternstroside E

C22H26O10 (450.15258960000006)

Kaempferol 3-O-beta-D-glucoside

C21H22O11 (450.11620619999997)

CHEBI:139404

C21H22O11 (450.11620619999997)

(6aS,7aR,8S,9R,11aR,11bS)-5-chloro-7a-hydroxy-3-[(1E,3R,4R)-4-hydroxy-3-methylpent-1-en-1-yl]-6a,8,9-trimethyl-6a,7a,8,9,11a,11b-hexahydro-6H,11H-pyrano[3,4:4,5]furo[2,3-h]-2-benzopyran-6,11-dione|4-epichaetomugilin A

(6aS,7aR,8S,9R,11aR,11bS)-5-chloro-7a-hydroxy-3-[(1E,3R,4R)-4-hydroxy-3-methylpent-1-en-1-yl]-6a,8,9-trimethyl-6a,7a,8,9,11a,11b-hexahydro-6H,11H-pyrano[3,4:4,5]furo[2,3-h]-2-benzopyran-6,11-dione|4-epichaetomugilin A

C23H27ClO7 (450.14452220000004)

kipukasin C

C20H22N2O10 (450.1274392)

4-O-beta-glucopyranosyl-6,7-dihydro-2,2,8-trimethyl-6,7-dioxo-2H-naphtho[1,8-bc]furan-5-carboxylic acid|bombamaloside

C21H22O11 (450.11620619999997)

8-hydroxy-3,7-dimethoxyxanthone-1-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

myricitin-3-O-alpha-L-rhamnopyranoside

C21H22O11 (450.11620619999997)

3,4,5-trimethoxyphenol O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

C18H26O13 (450.13733460000003)

rumexneposide B|torachrysone-8-O-b-D-(60-O-acetyl)glucopyranoside

C22H26O10 (450.15258960000006)

indigotide B

C22H26O10 (450.15258960000006)

(E)-3-[4-hydroxy-3-methoxy-5-[(4R)-6-methoxy-4-(sulfomethyl)chroman-3-yl]phenyl]prop-2-enoic acid|tarvanol A

C21H22O9S (450.0984482)

2-methyl-4-oxo-4H-pyran-3-yl 3-O-beta-D-glucopyranosyl-beta-D-glucopyranoside|petrorhagioside B

C18H26O13 (450.13733460000003)

2-methyl-4-oxo-4H-pyran-3-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside|petrorhagioside D

C18H26O13 (450.13733460000003)

indigotide H

C22H26O10 (450.15258960000006)

2?,4?-dihydroxy-3?-methoxydibenzoyl-4?-O-beta-D-glucopyranoside|sophodibenzoside K

C21H22O11 (450.11620619999997)

2,4-dihydroxy-4?-methoxy-6?-O-beta-glucopyranoside dihydrochalcone

C22H26O10 (450.15258960000006)

1-(4-hydroxy-2,5-dimethylphenyl)-6-vanilloyl-beta-D-glucopyranose|dunnianoside B

C22H26O10 (450.15258960000006)

thunberginol G 8-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

magniferin methyl ether

C21H22O11 (450.11620619999997)

(-)-Syringaresinol

C22H26O10 (450.15258960000006)

4-hydroxyacetophenone-4-O-beta-(6-galloyl)glucopyranoside|6-galloylpicein

C21H22O11 (450.11620619999997)

4-hydroxythunberginol G 3?-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

5,3,4,5-tetrahydroxyflavanone-7-O-rhamnopyranoside

C21H22O11 (450.11620619999997)

2?,3?-dihydroxy-4?-methoxydibenzoyl-4?-O-beta-D-glucopyranoside|sophodibenzoside C

C21H22O11 (450.11620619999997)

thunberginol D 3?-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

prupersin A

C22H26O10 (450.15258960000006)

Coatline A

C22H26O10 (450.15258960000006)

1,3-Dihydroxy-4,5-dimethoxyxanthone-3-O-??-D-glucopyranoside

C21H22O11 (450.11620619999997)

Neocarthamin

C21H22O11 (450.11620619999997)

A flavanone glycoside that is carthamidin attached to a beta-D-glucopyranosyl residue at position 5 via a glycosidic linkage.

perforatin G

C22H26O10 (450.15258960000006)

(4-beta-D-glucopyranosyloxy)-3-hydroxyphenyl caffeate

C21H22O11 (450.11620619999997)

2,4,6-trihydroxyacetophenone 3-C-beta-D-(2-O-p-hydroxybenzoyl)glucopyranoside|2,4,6-Trihydroxyacetophenone 3-C-??-(2-O-p-hydroxybenzoyl)-glucopyranoside

C21H22O11 (450.11620619999997)

Enhydrin|Polymatin C

C22H26O10 (450.15258960000006)

2,3,4,5,6-pentahydroxybenzophenone-2-O-(4-O-acetyl)-alpha-L-rhamnopyranoside|petiolin G

C21H22O11 (450.11620619999997)

8-desacyl enhydrin-(4-hydroxymethacrylate)|8-desacyl enhydrin-<4-hydroxymethacrylate>

C22H26O10 (450.15258960000006)

Kaempferol-3-O-glucoside

C21H22O11 (450.11620619999997)

2-(3,4-dihydroxyphenyl)ethyl 2-O-(4-hydroxyphenylethanoyl)-beta-D-glucopyranoside|ternstroside B

C22H26O10 (450.15258960000006)

2-O-benzoylaucubin

C22H26O10 (450.15258960000006)

12-hydroxycycloartobiloxanthone|artoindonesianin Z-2

C25H22O8 (450.1314612)

2-beta(?)-D-glucopyranosyloxy-4,3,4,6-tetrahydroxy-trans(?)-chalcone|2-beta(?)-D-Glucopyranosyloxy-4,3,4,6-tetrahydroxy-trans(?)-chalkon

C21H22O11 (450.11620619999997)

2-(3,4-dihydroxyphenyl)-7-beta-D-glucopyranosyl-8-hydroxychroman-4-one

C21H22O11 (450.11620619999997)

1,3-dihydroxy-2,7-dimethoxy-6-(alpha-L-rhamnopyranosyloxy)-9H-xanthen-9-one|6-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-1,3-dihydroxy-2,7-dimethoxy-9H-xanthen-9-one|sibiricaxanthone C

C21H22O11 (450.11620619999997)

luteolin 3-glucoside

C21H22O11 (450.11620619999997)

bockioside A

C21H22O11 (450.11620619999997)

aspalalinin

C21H22O11 (450.11620619999997)

3-Deglycosyl-Galtamycin

C25H22O8 (450.1314612)

6-acetylnodakenine

C22H26O10 (450.15258960000006)

MixCom6_000518

C24H22N2O7 (450.1426942)

2,4-O-Methylene,1,5-dibenzoyl,3-mesyl-Ribitol

C21H22O9S (450.0984482)

7-O-(2-beta-D-glucopyranosyl)eriodictyol

C21H22O11 (450.11620619999997)

gaboroquinones

C24H18O9 (450.0950778)

3-hydroxyl-2-methyl-4H-pyran-4-one-3-O-(6-O-caffeoyl)-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

1-hydroxy-3,6-dimethoxy-2-beta-D-glucopyranosyloxyxanthone

C21H22O11 (450.11620619999997)

7-O-beta-D-glucopyranosyl-eriodictyol

C21H22O11 (450.11620619999997)

2-hydroxy-1,4-dimethoxy-7-O-beta-D-glucopyranosylxanthone|prunifloroside A

C21H22O11 (450.11620619999997)

houttuynoside A

C21H22O11 (450.11620619999997)

Agnuside

C22H26O10 (450.15258960000006)

dunalianoside C

C21H22O11 (450.11620619999997)

Polydalin

C22H26O10 (450.15258960000006)

3-Glucosyl-isogentiacaulein

C21H22O11 (450.11620619999997)

3-Chlorostenosporic acid

C23H27ClO7 (450.14452220000004)

7-beta-D-Glucopyranosyloxy-1-hydroxy-3,8-dimethyoxyxanthone

C21H22O11 (450.11620619999997)

3-hydroxy-5-methoxyphenol-2-O-beta-apiofuranosyl-(1->2)-beta-glucopyranoside

C18H26O13 (450.13733460000003)

Ser Asp Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-hydroxybutanamido]pentanedioic acid

C16H26N4O11 (450.15980060000004)

Asp Trp Met

C20H26N4O6S (450.15729760000005)

3-C-glucosyl-2,4,4,6-tetrahydroxydibenzoylmethane

C21H22O11 (450.11620619999997)

2-[hydroperoxy-(4-glucosyl-hydroxyphenyl)methyl]-6-hydroxy-1-benzofuran-3-one

C21H22O11 (450.11620619999997)

6-C-glucosyl-2-hydroxynaringenin

C21H22O11 (450.11620619999997)

Protoapigenin 4-O-β-D-glucoside

C21H22O11 (450.11620619999997)

Taxifolin 7-O-rhamnoside

(2R,3R)-2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-7-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)chroman-4-one

C21H22O11 (450.11620619999997)

Flavanomarein

(S)-2-(3,4-dihydroxyphenyl)-8-hydroxy-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)chroman-4-one

C21H22O11 (450.11620619999997)

Acquisition and generation of the data is financially supported in part by CREST/JST. Flavanomarein is a natural product found in Abies pindrow with data available. Flavanomarein is a predominant flavonoid of Coreopsis tinctoria Nutt with protective effects against diabetic nephropathy. Flavanomarein has good antioxidative, antidiabetic, antihypertensive and anti-hyperlipidemic activities[1][2].

Eriodictyol-7-glucoside

Eriodictyol 7-O--D-glucoside

C21H22O11 (450.11620619999997)

Acquisition and generation of the data is financially supported in part by CREST/JST. Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1]. Eriodictyol-7-O-glucoside (Eriodictyol 7-O-β-D-glucoside), a flavonoid, is a potent free radical scavenger. Eriodictyol-7-O-glucoside is also an Nrf2 activator, confers protection against Cisplatin-induced toxicity[1].

Isookanin-7-glucoside

C21H22O11 (450.11620619999997)

diltiazem hydrochloride

C22H27ClN2O4S (450.1379972000001)

C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent > C333 - Calcium Channel Blocker D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker

Galtamycinone

C25H22O8 (450.1314612)

(2R,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

NCGC00384662-01!(2R,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

3-(3,4-dihydroxy-2,2-dimethyl-1-oxo-3aH-imidazo[1,2-a]indol-4-yl)-2-(4-oxoquinazolin-3-yl)propanoic acid

NCGC00380811-01!3-(3,4-dihydroxy-2,2-dimethyl-1-oxo-3aH-imidazo[1,2-a]indol-4-yl)-2-(4-oxoquinazolin-3-yl)propanoic acid

C23H22N4O6 (450.1539272)

(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one

NCGC00168909-02!(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

NCGC00169637-02!(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

NCGC00169505-02!3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

NCGC00384787-01!2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

C20H22N2O10_Uridine, 2-acetate 3-(4-hydroxy-2-methoxy-6-methylbenzoate)

NCGC00380770-01_C20H22N2O10_Uridine, 2-acetate 3-(4-hydroxy-2-methoxy-6-methylbenzoate)

C20H22N2O10 (450.1274392)

C22H26O10_[(1S)-1-(beta-D-Glucopyranosyloxy)-5-hydroxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl benzoate

NCGC00169681-03_C22H26O10_[(1S)-1-(beta-D-Glucopyranosyloxy)-5-hydroxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl benzoate

C22H26O10 (450.15258960000006)

C21H22O11_2,6-Dihydroxy-2-(4-hydroxybenzyl)-3-oxo-2,3-dihydro-1-benzofuran-4-yl beta-D-glucopyranoside

NCGC00168800-03_C21H22O11_2,6-Dihydroxy-2-(4-hydroxybenzyl)-3-oxo-2,3-dihydro-1-benzofuran-4-yl beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

C22H26O10_1-Propanone, 1-[2-(beta-D-glucopyranosyloxy)-4,6-dihydroxyphenyl]-3-(4-methoxyphenyl)

NCGC00385165-01_C22H26O10_1-Propanone, 1-[2-(beta-D-glucopyranosyloxy)-4,6-dihydroxyphenyl]-3-(4-methoxyphenyl)-

C22H26O10 (450.15258960000006)

C20H22N2O10_2,4(1H,3H)-Pyrimidinedione, 1-[2-O-acetyl-3-O-(4-hydroxy-2-methoxy-6-methylbenzoyl)pentofuranosyl]

NCGC00169855-03_C20H22N2O10_2,4(1H,3H)-Pyrimidinedione, 1-[2-O-acetyl-3-O-(4-hydroxy-2-methoxy-6-methylbenzoyl)pentofuranosyl]-

C20H22N2O10 (450.1274392)

C23H22N4O6_1H-Imidazo[1,2-a]indole-9-propanoic acid, 2,3,9,9a-tetrahydro-1,9-dihydroxy-2,2-dimethyl-3-oxo-alpha-(4-oxo-3(4H)-quinazolinyl)

NCGC00380811-02_C23H22N4O6_1H-Imidazo[1,2-a]indole-9-propanoic acid, 2,3,9,9a-tetrahydro-1,9-dihydroxy-2,2-dimethyl-3-oxo-alpha-(4-oxo-3(4H)-quinazolinyl)-

C23H22N4O6 (450.1539272)

C18H26O13_Cyclopenta[c]pyran-4,7-dicarboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,6-dihydroxy-, dimethyl ester, (1S,4aS,6R,7R,7aS)

NCGC00384661-01_C18H26O13_Cyclopenta[c]pyran-4,7-dicarboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,6-dihydroxy-, dimethyl ester, (1S,4aS,6R,7R,7aS)-

C18H26O13 (450.13733460000003)

(2R,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

[(1S)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl benzoate

C22H26O10 (450.15258960000006)

[4-acetyloxy-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] 4-hydroxy-2-methoxy-6-methylbenzoate

C20H22N2O10 (450.1274392)

1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-methoxyphenyl)propan-1-one

C22H26O10 (450.15258960000006)

3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

Isookanin-7-O-glucoside

C21H22O11 (450.11620619999997)

Annotation level-1

Eriodictyol-7-O-glucoside

C21H22O11 (450.11620619999997)

Annotation level-1

(2R,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one [IIN-based: Match]

NCGC00384662-01!(2R,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one [IIN-based: Match]

C21H22O11 (450.11620619999997)

Eriodictryol 7-O-glucoside

C21H22O11 (450.11620619999997)

[4-acetyloxy-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] 4-hydroxy-2-methoxy-6-methylbenzoate_major

C20H22N2O10 (450.1274392)

[4-acetyloxy-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] 4-hydroxy-2-methoxy-6-methylbenzoate_70.6\\%

C20H22N2O10 (450.1274392)

1-[2,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-methoxyphenyl)propan-1-one_major

C22H26O10 (450.15258960000006)

3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one_major

C21H22O11 (450.11620619999997)

Ala Cys Glu Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-carboxybutanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Ala Asp Asp Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H26N4O9S (450.1420426000001)

Ala Asp Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Ala Glu Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-3-sulfanylpropanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Ala Glu Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Ala Met Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Cys Ala Glu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-4-carboxybutanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Cys Cys Glu Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C16H26N4O7S2 (450.1242846)

Cys Cys Pro Glu

(2S)-2-{[(2S)-1-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C16H26N4O7S2 (450.1242846)

Cys Asp Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C16H26N4O9S (450.1420426000001)

Cys Asp Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-methylbutanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Cys Glu Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carboxybutanamido]propanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Cys Glu Cys Pro

(2S)-1-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carboxybutanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C16H26N4O7S2 (450.1242846)

Cys Glu Glu Ala

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-3-carboxy-1-{[(1S)-1-carboxyethyl]carbamoyl}propyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Cys Glu Pro Cys

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-5-[(2S)-2-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C16H26N4O7S2 (450.1242846)

Cys Asn Asn Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanoic acid

C15H26N6O8S (450.15327560000003)

Cys Asn Gln Ser

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Asn Ser Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Cys Asn Thr Asn

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Pro Cys Glu

(2S)-2-[(2R)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]pentanedioic acid

C16H26N4O7S2 (450.1242846)

Cys Pro Glu Cys

(4S)-4-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C16H26N4O7S2 (450.1242846)

Cys Gln Asn Ser

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Gln Ser Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Ser Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Cys Ser Gln Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Thr Asn Asn

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Cys Val Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]-3-carboxypropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Ala Asp Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Ala Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Cys Asp Val

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C16H26N4O9S (450.1420426000001)

Asp Cys Val Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-methylbutanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Asp Ala Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]propanamido]-4-(methylsulfanyl)butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Asp Cys Val

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-3-methylbutanoic acid

C16H26N4O9S (450.1420426000001)

Asp Asp Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C15H22N4O12 (450.1234172)

Asp Asp Met Ala

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

Asp Asp Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]-3-hydroxypropanamido]butanedioic acid

C15H22N4O12 (450.1234172)

Asp Asp Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C16H26N4O11 (450.15980060000004)

Asp Asp Val Cys

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

Asp Glu Gly Met

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-[({[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Glu Met Gly

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Glu Ser Thr

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Asp Glu Thr Ser

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-{[(1S,2R)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Asp Gly Glu Met

(4S)-4-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Gly Met Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-4-(methylsulfanyl)butanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Met Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]propanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Met Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

Asp Met Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C16H26N4O9S (450.1420426000001)

Asp Met Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]acetamido}pentanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Ser Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-carboxypropanamido]butanedioic acid

C15H22N4O12 (450.1234172)

Asp Ser Glu Thr

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-4-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Asp Ser Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]pentanedioic acid

C16H26N4O11 (450.15980060000004)

Asp Thr Asp Thr

(2S,3R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-3-carboxypropanamido]-3-hydroxybutanoic acid

C16H26N4O11 (450.15980060000004)

Asp Thr Glu Ser

(4S)-4-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Asp Thr Ser Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]pentanedioic acid

C16H26N4O11 (450.15980060000004)

Asp Thr Thr Asp

(2S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]butanedioic acid

C16H26N4O11 (450.15980060000004)

Asp Val Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-sulfanylpropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Val Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

Glu Ala Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-3-sulfanylpropanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Glu Ala Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Cys Ala Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]propanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Glu Cys Cys Pro

(2S)-1-[(2R)-2-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C16H26N4O7S2 (450.1242846)

Glu Cys Glu Ala

(4S)-4-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Cys Pro Cys

(4S)-4-amino-4-{[(2R)-1-[(2S)-2-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}butanoic acid

C16H26N4O7S2 (450.1242846)

Glu Asp Gly Met

(4S)-4-amino-4-{[(1S)-2-carboxy-1-[({[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Asp Met Gly

(4S)-4-amino-4-{[(1S)-2-carboxy-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Asp Ser Thr

(4S)-4-amino-4-{[(1S)-2-carboxy-1-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Glu Asp Thr Ser

(4S)-4-amino-4-{[(1S)-2-carboxy-1-{[(1S,2R)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Glu Glu Ala Cys

(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Glu Cys Ala

(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Glu Ser Ser

(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N4O11 (450.15980060000004)

Glu Gly Asp Met

(4S)-4-amino-4-[({[(1S)-2-carboxy-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Gly Met Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-carboxybutanamido]acetamido}-4-(methylsulfanyl)butanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Glu Met Asp Gly

(4S)-4-amino-4-{[(1S)-1-{[(1S)-2-carboxy-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Glu Met Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]acetamido}butanedioic acid

C16H26N4O9S (450.1420426000001)

Glu Pro Cys Cys

(4S)-4-amino-5-[(2S)-2-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C16H26N4O7S2 (450.1242846)

Gly Asp Glu Met

(4S)-4-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Gly Asp Met Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Gly Glu Asp Met

(4S)-4-(2-aminoacetamido)-4-{[(1S)-2-carboxy-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Gly Glu Met Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Gly Met Asp Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Gly Met Glu Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Asp Met Trp

C20H26N4O6S1 (450.15729760000005)

Met Trp Asp

C20H26N4O6S1 (450.15729760000005)

Asp Trp Met

C20H26N4O6S1 (450.15729760000005)

Met Ala Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]propanamido]-3-carboxypropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Met Asp Trp

C20H26N4O6S1 (450.15729760000005)

Met Asp Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]propanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Met Asp Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

Met Asp Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C16H26N4O9S (450.1420426000001)

Met Asp Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]acetamido}pentanedioic acid

C16H26N4O9S (450.1420426000001)

Met Glu Asp Gly

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-{[(1S)-2-carboxy-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C16H26N4O9S (450.1420426000001)

Met Glu Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]acetamido}butanedioic acid

C16H26N4O9S (450.1420426000001)

Met Gly Asp Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-carboxypropanamido]pentanedioic acid

C16H26N4O9S (450.1420426000001)

Met Gly Glu Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-4-carboxybutanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Trp Asp Met

C20H26N4O6S1 (450.15729760000005)

Asn Cys Asn Thr

(2S,3R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanoic acid

C15H26N6O8S (450.15327560000003)

Asn Cys Gln Ser

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Cys Ser Gln

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Asn Cys Thr Asn

(2S)-2-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Trp Met Asp

C20H26N4O6S1 (450.15729760000005)

Asn Asn Cys Thr

(2S,3R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C15H26N6O8S (450.15327560000003)

Asn Asn Thr Cys

(2R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Gln Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Gln Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Ser Cys Gln

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Asn Ser Gln Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Thr Cys Asn

(2S)-2-[(2R)-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Asn Thr Asn Cys

(2R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Pro Cys Cys Glu

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]pentanedioic acid

C16H26N4O7S2 (450.1242846)

Pro Cys Glu Cys

(4S)-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-4-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]butanoic acid

C16H26N4O7S2 (450.1242846)

Pro Glu Cys Cys

(4S)-4-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C16H26N4O7S2 (450.1242846)

Gln Cys Asn Ser

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Gln Cys Ser Asn

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Gln Asn Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C15H26N6O8S (450.15327560000003)

Gln Asn Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Gln Ser Cys Asn

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Gln Ser Asn Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Ser Cys Asn Gln

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Ser Cys Gln Asn

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Ser Asp Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-carboxypropanamido]butanedioic acid

C15H22N4O12 (450.1234172)

Ser Asn Cys Gln

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanoic acid

C15H26N6O8S (450.15327560000003)

Ser Asn Gln Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Ser Gln Cys Asn

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Ser Gln Asn Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Thr Cys Asn Asn

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Thr Asn Cys Asn

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C15H26N6O8S (450.15327560000003)

Thr Asn Asn Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C15H26N6O8S (450.15327560000003)

Val Cys Asp Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-methylbutanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Val Asp Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]butanedioic acid

C16H26N4O9S (450.1420426000001)

Val Asp Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C16H26N4O9S (450.1420426000001)

AN-7

3-(5-[1,2]dithiolan-3yl-pentanoylamino)-propyl]-amide

C19H34N2O2S4 (450.1503024)

3,4,2,4,6-Pentahydroxychalcone 4-glucoside

C21H22O11 (450.11620619999997)

8-C-Glucopyranosyleriodictylol

C21H22O11 (450.11620619999997)

Eriodictyol 7-O-glucoside

C21H22O11 (450.11620619999997)

Tyr-Phe-OH

(S)-2-(3-(4-hydroxyphenethoxy)-4-nitrobenzamido)-3-phenylpropanoic acid

C24H22N2O7 (450.1426942)

Phe-TyrMe-OH

(S)-2-(3-(benzyloxy)-4-nitrobenzamido)-4-(4-methoxyphenyl)butanoic acid

C24H22N2O7 (450.1426942)

HoPhe-Tyr-OH

(S)-3-(4-hydroxyphenyl)-2-(4-nitro-3-phenethoxybenzamido)propanoic acid

C24H22N2O7 (450.1426942)

Maesopsin 6-glucoside

2,4-dihydroxy-2-[(4-hydroxyphenyl)methyl]-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-3-one

C21H22O11 (450.11620619999997)

Melleolide L

3-formyl-2a,7-dihydroxy-6,6,7b-trimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate

C23H27ClO7 (450.14452220000004)

Isocarthamin

6,7-dihydroxy-2-(4-hydroxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

(±)-Flufenprox

1-chloro-4-(3-{[2-(4-ethoxyphenyl)-3,3,3-trifluoropropoxy]methyl}phenoxy)benzene

C24H22ClF3O3 (450.12094880000006)

Phloretin 2'-O-glucuronide

(2S,3S,4S,5R,6S)-6-{3,5-dihydroxy-2-[3-(4-hydroxyphenyl)propanoyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C21H22O11 (450.11620619999997)

((1S)-5-hydroxy-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl)methyl benzoate

C22H26O10 (450.15258960000006)

HhAntag

C24H23ClN4O3 (450.14585980000004)

D-Glutamic acid, N-[4-[2-(2-amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-, disodium salt

C20H21N5NaO6 (450.13894660000005)

CCG-63802

C26H18N4O2S (450.1150408)

(2R-trans)-DiltiazeM Hydrochloride

C22H27ClN2O4S (450.1379972000001)

1-[7-(4-ethyl-5-methyl-2H-1,2,3-triazol-2-yl)-2-oxo-2H-1-benzopyran-3-yl]-4-methyl-1H-1,2,4-triazolium methyl sulphate

C18H22N6O6S (450.1321472)

magnesium gluconate

D-Gluconicacid, magnesium salt, hydrate (2:1:2)

C12H26MgO16 (450.1071296)

A - Alimentary tract and metabolism > A12 - Mineral supplements > A12C - Other mineral supplements > A12CC - Magnesium

4-(6-(BENZOYLOXY)BENZO[B]THIOPHEN-2-YL)PHENYL BENZOATE

C28H18O4S (450.0925748)

dimethyl benzene-1,3-dicarboxylate,2,3-dimethylterephthalic acid,ethane-1,2-diol

C22H26O10 (450.15258960000006)

CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-

C25H26N2O2S2 (450.1435616)

Diethyl [10-(diethoxyphosphoryl)-anthracen-9-yl]phosphonate

C22H28O6P2 (450.1361048)

1,3,6,8,10,13,16,19-OCTAAZABICYCLO[6.6.6]EICOSANECOBALT TRICHLORIDE

C12H30Cl3CoN8 (450.099087)

sodium tetrakis(4-fluorophenyl)borate

C24H20BF4NaO2 (450.1390098)

TRANS-4-(4-(DIBUTYLAMINO)STYRYL)-1-METH&

C22H31IN2 (450.15318759999997)

Suvorexant

Suvorexant(MK-4305)

C23H23ClN6O2 (450.1570928)

D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C142786 - Orexin Receptor Antagonist D018377 - Neurotransmitter Agents > D000068796 - Orexin Receptor Antagonists N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives

Solvent Green 20

C28H22N2O4 (450.1579492)

s-(2-hydroxy-5-nitrobenzyl)-6-thioguanosine

C17H18N6O7S (450.09576380000004)

Solvent Green 28

C28H22N2O4 (450.1579492)

Hydroxyzine D4 Dihydrochloride

C21H25Cl3D4N2O2 (450.15455911199996)

2-iodo-2,4,6-triisopropyl-3-methoxy-6-methyl-1,1-biphenyl

C23H31IO (450.14195459999996)

C23H27ClO7

C23H27ClO7 (450.14452220000004)

(R)-(4-(5-chlorobenzo[d]oxazol-2-yl)-7-Methyl-1,4-diazepan-1-yl)(5-Methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)Methanone

C23H23ClN6O2 (450.1570928)

(neodecanoato-O)phenylmercury

C16H24HgO2 (450.14825239999993)

diacenaphtho(1,2-j:1,2-l)fluoranthene

C36H18 (450.1408428)

5-(4-chlorophenoxy)-N,N-diethyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxamide

C21H18ClF3N4O2 (450.1070314)

Tris(4-methylphenyl)sulfonium hexafluorophosphate

C21H21F6PS (450.10057080000007)

Nemorexant

C23H23ClN6O2 (450.1570928)

C78272 - Agent Affecting Nervous System > C142786 - Orexin Receptor Antagonist

Iclaprim mesylate

C20H26N4O6S (450.15729760000005)

C254 - Anti-Infective Agent > C52588 - Antibacterial Agent

1-(4-Hydroxyphenyl)-3-(2,4,6-trihydroxy-3-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)phenyl)propane-1,3-dione

C21H22O11 (450.11620619999997)

(4-(5-chlorobenzo[d]oxazol-2-yl)-7-methyl-1,4-diazepan-1-yl)(5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)methanone

C23H23ClN6O2 (450.1570928)

Ternstroside B

C22H26O10 (450.15258960000006)

A beta-D-glucoside with 2-(3,4-dihydroxyphenyl)ethoxy residue at the anomeric position and a [(4-hydroxyphenyl)acetyl]oxy residue at position 2. Isolated from Ternstroemia japonica, it exhibits antioxidant activity.

Ternstroside E

C22H26O10 (450.15258960000006)

A beta-D-glucoside with 2-(4-hydroxyphenyl)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.

Flufenprox

C24H22ClF3O3 (450.12094880000006)

chaetomugilin A

C23H27ClO7 (450.14452220000004)

An azaphilone isolated from Chaetomium globosum and has been shown to exhibit inhibitory activity against the brine shrimp (Artemia salina) and Mucor miehei.

Ent-diltiazem hydrochloride

C22H27ClN2O4S (450.1379972000001)

N-[2,5-dioxo-6-(4-phenoxyphenyl)-3-pyrano[3,2-c]pyridinyl]benzamide

C27H18N2O5 (450.1215658)

2,4,6-Tris(4-fluorophenyl)pyrylium tetrafluoroborate

C23H14BF7O (450.1025868)

CGS-12066A maleate

C21H21F3N4O4 (450.15148220000003)

D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists

(5r,6s,8s)-8-[3-(Aminomethyl)phenyl]-6-Hydroxy-5-Isopropyl-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide

C21H27N2O7P (450.15558020000003)

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

C21H22O11 (450.11620619999997)

2,6-Dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one

C21H22O11 (450.11620619999997)

(E)-3-(3,4-dihydroxyphenyl)-1-[2,3-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one

C21H22O11 (450.11620619999997)

1-[2-(beta-D-Glucopyranosyloxy)-4,6-dihydroxyphenyl]-3-(4-methoxyphenyl)-1-propanone

C22H26O10 (450.15258960000006)

Eriodictyol-8-C-glucoside

(2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-4-one

C21H22O11 (450.11620619999997)

S-[(1R,2S)-1-(2-chlorophenyl)-2-(4-fluorophenyl)-1-hydroxy-3-(1H-1,2,4-triazol-1-yl)propan-2-yl]-L-cysteine

C20H20ClFN4O3S (450.0928612)

2,3,4,4,6-Pentahydroxychalcone 4-O-beta-D-glucoside

C21H22O11 (450.11620619999997)

13-hydroxymelleolide K

C23H27ClO7 (450.14452220000004)

IAA-aspartate-N-beta-D-glucose

C20H22N2O10-2 (450.1274392)

2,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3H-chromen-4-one

C21H22O11 (450.11620619999997)

2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C21H22O11 (450.11620619999997)

N-[4-[(1,4-dioxo-3-pyridin-1-ium-1-yl-2,3-dihydronaphthalen-2-yl)sulfamoyl]phenyl]acetamide

C23H20N3O5S+ (450.1123610000001)

Gaboroquinone A

C24H18O9 (450.0950778)

An anthraquinone that is anthracene-9,10-dione substituted by a 3-acetyl-4,6-dihydroxy-2-methoxyphenyl moiety at position 1, hydroxy groups at positions 4 and 5 and a hydroxymethyl group at position 2. Isolated from the roots of Bulbine frutescens, it exhibits antiplasmodial and antitrypanosomal activities.

2-(6-Methoxy-1-Oxo-1,3-Dihydro-2h-Isoindol-2-Yl)-N-[4-(Piperazin-1-Yl)pyridin-3-Yl]-1,3-Thiazole-4-Carboxamide

C22H22N6O3S (450.1474022)

Asebotoside

1-[2-hydroxy-4-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one

C22H26O10 (450.15258960000006)

2-Naphthalenecarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

C27H18N2O3S (450.1038078)

4-[4-(4-Methylphenyl)sulfonyl-1-piperazinyl]-2-thiophen-2-ylquinazoline

C23H22N4O2S2 (450.11841119999997)

Glycine, N-[2-methoxy-5-[[[(1E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl]methyl]phenyl]-, sodium salt (1:1)

C21H24NO8S- (450.1222564)

3-(3,4-dihydroxy-2,2-dimethyl-1-oxo-3aH-imidazo[1,2-a]indol-4-yl)-2-(4-oxoquinazolin-3-yl)propanoic acid

C23H22N4O6 (450.1539272)

Fragarin

C21H22O11 (450.11620619999997)

Maesopsin 4-O-glucoside

C21H22O11 (450.11620619999997)

N-[[5-[(4-chlorophenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]-4-ethoxyaniline

C24H23ClN4OS (450.1281018)

N-[[5-(1H-benzimidazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-5-chloro-2-methoxybenzamide

C23H19ClN4O2S (450.09171840000005)

N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

C21H26N2O5S2 (450.12830660000003)

N-[5-[2-(5-chloro-2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]hexanamide

C20H23ClN4O2S2 (450.0950888)

N-(3-chlorophenyl)-2-[4-oxo-2-phenylimino-3-(2-pyridinylmethyl)-5-thiazolidinyl]acetamide

C23H19ClN4O2S (450.09171840000005)

[1-(2-Adamantylamino)-1-oxopropan-2-yl] 4-methylsulfonyl-3-nitrobenzoate

C21H26N2O7S (450.14606460000005)

(2R,3R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chroman-4-one

C21H22O11 (450.11620619999997)

Trp-Met-Asp

C20H26N4O6S (450.15729760000005)

beta-citryl-Glu-Glu

C16H22N2O13 (450.1121842)

(2S)-5,7,3,5-tetrahydroxyflavanone-7-O-beta-D-glucopyranoside

C21H22O11 (450.11620619999997)

A flavanone glycoside that is (2S)-5,7,3,5-tetrahydroxyflavanone attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. Isolated from Jasminum lanceolarium, it exhibits radical scavenging activity.