Exact Mass: 546.0651894

Exact Mass Matches: 546.0651894

Found 96 metabolites which its exact mass value is equals to given mass value 546.0651894, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Ceftazidime

(6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-8-oxo-3-(pyridinium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C22H22N6O7S2 (546.0991342)


Ceftazidime is only found in individuals that have used or taken this drug. It is a semisynthetic, broad-spectrum antibacterial derived from cephaloridine and used especially for Pseudomonas and other gram-negative infections in debilitated patients. [PubChem]The bactericidal activity of ceftazidime results from the inhibition of cell wall synthesis via affinity for penicillin-binding proteins (PBPs). J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DD - Third-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

dTDP-4-dehydro-6-deoxy-beta-L-mannose

{[(2R,3R,4S,6S)-3,4-dihydroxy-6-methyl-5-oxooxan-2-yl]oxy}({[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy})phosphinic acid

C16H24N2O15P2 (546.0651894)


Dtdp-4-dehydro-6-deoxy-beta-l-mannose, also known as dtdp-4-oxo-L-rhamnose or dtdp-6-deoxy-beta-L-lyxo-hex-4-ulose, is a member of the class of compounds known as pyrimidine nucleotide sugars. Pyrimidine nucleotide sugars are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Dtdp-4-dehydro-6-deoxy-beta-l-mannose is soluble (in water) and a moderately acidic compound (based on its pKa). Dtdp-4-dehydro-6-deoxy-beta-l-mannose can be found in a number of food items such as rose hip, white cabbage, fennel, and shallot, which makes dtdp-4-dehydro-6-deoxy-beta-l-mannose a potential biomarker for the consumption of these food products. Dtdp-4-dehydro-6-deoxy-β-l-mannose, also known as dtdp-4-oxo-L-rhamnose or dtdp-6-deoxy-beta-L-lyxo-hex-4-ulose, is a member of the class of compounds known as pyrimidine nucleotide sugars. Pyrimidine nucleotide sugars are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Dtdp-4-dehydro-6-deoxy-β-l-mannose is soluble (in water) and a moderately acidic compound (based on its pKa). Dtdp-4-dehydro-6-deoxy-β-l-mannose can be found in a number of food items such as rose hip, white cabbage, fennel, and shallot, which makes dtdp-4-dehydro-6-deoxy-β-l-mannose a potential biomarker for the consumption of these food products.

   

dTDP-3-oxo-6-deoxy-D-glucose

3,6-Dideoxy-3-oxo-dTDP-D-glucose; dTDP-3-oxo-6-deoxy-D-glucose; dTDP-3-oxo-6-deoxy-alpha-D-glucose; dTDP-3-dehydro-6-deoxy-alpha-D-glucopyranose; dTDP-6-deoxy-D-ribo-hexos-3-ulose

C16H24N2O15P2 (546.0651894)


   

dTDP-L-mycarose

dTDP-L-mycarose; dTDP-beta-L-mycarose; dTDP-2,6-dideoxy-3-C-methyl-beta-L-ribo-hexose

C17H28N2O14P2 (546.1015728)


A dTDP-sugar having beta-L-mycarose as the sugar component.

   
   

dTDP-3-methyl-4-oxo-alpha-D-ribopyranose

dTDP-3-methyl-4-oxo-alpha-D-ribopyranose

C16H24N2O15P2 (546.0651894)


   

dTDP-4-oxo-6-deoxy-D-glucose

{[(2R,3R,4R,6R)-3,4-dihydroxy-6-methyl-5-oxooxan-2-yl]oxy}({[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy})phosphinic acid

C16H24N2O15P2 (546.0651894)


dTDP-4-oxo-6-deoxy-D-glucose belongs to the class of organic compounds known as pyrimidine nucleotide sugars. These are pyrimidine nucleotides bound to a saccharide derivative through the terminal phosphate group. Outside of the human body, dTDP-4-oxo-6-deoxy-D-glucose has been detected, but not quantified in, several different foods, such as common thymes, kumquats, cascade huckleberries, red huckleberries, and lotus. This could make dTDP-4-oxo-6-deoxy-D-glucose a potential biomarker for the consumption of these foods. dTDP-4-oxo-6-deoxy-D-glucose is a product of the enzyme TDP-glucose 4,6-dehydratase (EC 4.2.1.46) in the nucleotide sugars metabolism pathway. 4,6-Dideoxy-4-oxo-dTDP-D-glucose is a product of the enzyme TDP-glucose 4,6-dehydratase [EC:4.2.1.46] in the Nucleotide sugars metabolism (KEGG) [HMDB]

   

alpha-Gala-gala-gala

(1,4-alpha-D-Galacturonosyl)n

C18H26O19 (546.1068246)


   

dTDP-3-dehydro-6-deoxy-alpha-D-galactose

dTDP-3-dehydro-6-deoxy-alpha-D-galactose

C16H24N2O15P2 (546.0651894)


   

dTDP-D-mycarose

dTDP-beta-D-mycarose

C17H28N2O14P2 (546.1015728)


   

alpha-D-Galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonic acid

(2S,3R,4S,5R)-6-[(2S,3R,4R,5R)-2-carboxy-6-[(2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H26O19 (546.1068246)


alpha-D-Galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonic acid is isolated from enzymic hydrolysates (yeast or mould pectinases) of pectic acid. Also from partial acid hydrolysis of Medicago sativa (lucerne) pectin. Isolated from enzymic hydrolysates (yeast or mould pectinases) of pectic acidand is) also from partial acid hydrolysis of Medicago sativa (lucerne) pectin

   

Orange B

4-[(e)-2-[3-(Ethoxycarbonyl)-4-oxo-1-(4-sulphophenyl)-4,5-dihydro-1H-pyrazol-5-yl]diazen-1-yl]naphthalene-1-sulphonic acid

C22H18N4O9S2 (546.0515178)


Colourant for frankfurter and sausage casings Orange B is a food dye from the azo dye group. It is approved by Food and Drug Administration (FDA) for use only in hot dog and sausage casings or surfaces, only up to 150 ppm of the finished food weight.[citation needed] It usually comes as disodium salt. Colourant for frankfurter and sausage casings

   

Ceftazidime anhydrous

1-({7-[2-(2-amino-1,3-thiazol-4-yl)-2-[(1-carboxy-1-methylethoxy)imino]acetamido]-2-carboxylato-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl}methyl)pyridin-1-ium

C22H22N6O7S2 (546.0991342)


   
   

dTDP-4-dehydro-beta-L-rhamnose

dTDP-4-dehydro-6-deoxy-alpha-D-glucose

C16H24N2O15P2 (546.0651894)


   

Ustilaginoidin C

Ustilaginoidin C

C28H18O12 (546.0798228)


A binaphthopyran resulting from the formal oxidative coupling at position 9 of two molecules of 5,6,8-trihydroxy-2-(hydroxymethyl)-4H-naphtho[2,3-b]pyran-4-one.

   

4-O-methylellagic acid 3-(2,3-di-O-acetyl)-alpha-L-rhamnoside|4-O-Methylellagic acid 3-(2,3-di-O-acetyl)-??-L-rhamnoside|4-O-methylellagic acid 3-(2,3-di-O-acetyl)-3-alpha-rhamnoside

4-O-methylellagic acid 3-(2,3-di-O-acetyl)-alpha-L-rhamnoside|4-O-Methylellagic acid 3-(2,3-di-O-acetyl)-??-L-rhamnoside|4-O-methylellagic acid 3-(2,3-di-O-acetyl)-3-alpha-rhamnoside

C25H22O14 (546.1009512)


   

4xi,5xi-di(3,4-dihydroxy-(E)-cinnamoyl)-2,6xi-dihydroxyhept-2-en-1,7-dioic acid

4xi,5xi-di(3,4-dihydroxy-(E)-cinnamoyl)-2,6xi-dihydroxyhept-2-en-1,7-dioic acid

C25H22O14 (546.1009512)


   

rhein-8-O-beta-D-[6-O-(3-methoxymalonyl)]glucopyranoside

rhein-8-O-beta-D-[6-O-(3-methoxymalonyl)]glucopyranoside

C25H22O14 (546.1009512)


   

Pectic acid

(2S,3R,4S,5R)-6-[(2S,3R,4R,5R)-2-carboxy-6-[(2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H26O19 (546.1068246)


   

D-Trimannuronic acid

D-Trimannuronic acid

C18H26O19 (546.1068246)


   

Ceftazidime

Ceftazidime

C22H22N6O7S2 (546.0991342)


A cephalosporin bearing pyridinium-1-ylmethyl and {[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetamido groups at positions 3 and 7, respectively, of the cephem skeleton. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DD - Third-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams CONFIDENCE standard compound; EAWAG_UCHEM_ID 3238

   

orange B

4-[(E)-2-[3-(ethoxycarbonyl)-4-oxo-1-(4-sulfophenyl)-4,5-dihydro-1H-pyrazol-5-yl]diazen-1-yl]naphthalene-1-sulfonic acid

C22H18N4O9S2 (546.0515178)


   

Trigalacturonic acid

(2S,3R,4S,5R)-6-[(2S,3R,4R,5R)-2-carboxy-6-[(2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H26O19 (546.1068246)


   

1-[[(6R,7R)-7-[[(2E)-(2-Amino-4-thiazolyl)[(1-carboxy-1-methylethoxy)imino]acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-pyridinium inner salt

1-[[(6R,7R)-7-[[(2E)-(2-Amino-4-thiazolyl)[(1-carboxy-1-methylethoxy)imino]acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-pyridinium inner salt

C22H22N6O7S2 (546.0991342)


   

[4-({4-(6-Methoxy-3-pyridinyl)-5-[4-(trifluoromethoxy)phenyl]-1,3 -thiazol-2-yl}methoxy)-2-methylphenoxy]acetic acid

[4-({4-(6-Methoxy-3-pyridinyl)-5-[4-(trifluoromethoxy)phenyl]-1,3 -thiazol-2-yl}methoxy)-2-methylphenoxy]acetic acid

C26H21F3N2O6S (546.1072362)


   

3-chloro-N-[5-[(4-chlorobenzoyl)amino]-4,8-dihydroxy-9,10-dioxoanthracen-1-yl]benzamide

3-chloro-N-[5-[(4-chlorobenzoyl)amino]-4,8-dihydroxy-9,10-dioxoanthracen-1-yl]benzamide

C28H16Cl2N2O6 (546.0385375999999)


   

N,N-(9,10-dihydro-4,8-dihydroxy-9,10-dioxoanthracene-1,5-diyl)bis[4-chlorobenzamide]

N,N-(9,10-dihydro-4,8-dihydroxy-9,10-dioxoanthracene-1,5-diyl)bis[4-chlorobenzamide]

C28H16Cl2N2O6 (546.0385375999999)


   

Zinc bis(O,O-dibutyl phosphorodithioate)

Zinc bis(O,O-dibutyl phosphorodithioate)

C16H36O4P2S4Zn (546.0263046)


   

1,1,1-TRIS(4-TRIFLUOROVINYLOXYPHENYL)ETHANE

1,1,1-TRIS(4-TRIFLUOROVINYLOXYPHENYL)ETHANE

C26H15F9O3 (546.0877428)


   

β-D-Mannopyranuronic acid

β-D-Mannopyranuronic acid

C18H26O19 (546.1068246)


Alginic acid is a natural polysaccharide, which has been widely concerned and applied due to its excellent water solubility, film formation, biodegradability and biocompatibility. Alginic acid induces oxidative stress-mediated hormone secretion disorder, apoptosis and autophagy in mouse granulosa cells and ovaries. Alginic acid has an inhibitory effect on histamine release. Anti-anaphylactic and anti-inflammatory properties[1][2][3]. Alginic acid is a natural polysaccharide, which has been widely concerned and applied due to its excellent water solubility, film formation, biodegradability and biocompatibility. Alginic acid induces oxidative stress-mediated hormone secretion disorder, apoptosis and autophagy in mouse granulosa cells and ovaries. Alginic acid has an inhibitory effect on histamine release. Anti-anaphylactic and anti-inflammatory properties[1][2][3].

   
   
   

[(R,R)-MsDPEN-Ru(Mesitylene)Cl], Ru

[(R,R)-MsDPEN-Ru(Mesitylene)Cl], Ru

C24H29ClN2O2RuS (546.0681564)


   

dTDP-4-dehydro-6-deoxy-D-galactose

dTDP-4-dehydro-6-deoxy-D-galactose

C16H24N2O15P2 (546.0651894)


   

alpha-D-GalpA-(1->4)-alpha-D-GalpA-(1->4)-alpha-D-GalpA

alpha-D-GalpA-(1->4)-alpha-D-GalpA-(1->4)-alpha-D-GalpA

C18H26O19 (546.1068246)


A trisaccharide in which three alpha-D-galactopyranuronic acid units are joined via (1->4)-linkages.

   
   

UDP-4-dehydro-6-deoxy-alpha-D-glucose(2-)

UDP-4-dehydro-6-deoxy-alpha-D-glucose(2-)

C15H20N2O16P2-2 (546.028806)


   
   

dTDP-6-deoxy-beta-L-mannose(2-)

dTDP-6-deoxy-beta-L-mannose(2-)

C16H24N2O15P2-2 (546.0651894)


   

UDP-4-dehydro-beta-L-rhamnose

UDP-4-dehydro-beta-L-rhamnose

C15H20N2O16P2-2 (546.028806)


   

dTDP-4-amino-4,6-dideoxy-alpha-D-glucose(1-)

dTDP-4-amino-4,6-dideoxy-alpha-D-glucose(1-)

C16H26N3O14P2- (546.0889976)


   
   

dTDP-6-deoxy-alpha-D-allose(2-)

dTDP-6-deoxy-alpha-D-allose(2-)

C16H24N2O15P2-2 (546.0651894)


   

dTDP-4-amino-4,6-dideoxy-alpha-D-galactose(1-)

dTDP-4-amino-4,6-dideoxy-alpha-D-galactose(1-)

C16H26N3O14P2- (546.0889976)


   

dTDP-3-azaniumyl-3,6-dideoxy-alpha-D-glucose(1-)

dTDP-3-azaniumyl-3,6-dideoxy-alpha-D-glucose(1-)

C16H26N3O14P2- (546.0889976)


   

dTDP-3-amino-3,6-dideoxy-alpha-D-galactopyranose(1-)

dTDP-3-amino-3,6-dideoxy-alpha-D-galactopyranose(1-)

C16H26N3O14P2- (546.0889976)


   

dTDP-beta-D-fuco-(1->4)-furanose

dTDP-beta-D-fuco-(1->4)-furanose

C16H24N2O15P2-2 (546.0651894)


   
   

dTDP-4-dehydro-6-deoxy-alpha-D-gulose

dTDP-4-dehydro-6-deoxy-alpha-D-gulose

C16H24N2O15P2 (546.0651894)


   

dTDP-3-dehydro-6-deoxy-alpha-D-glucose

dTDP-3-dehydro-6-deoxy-alpha-D-glucose

C16H24N2O15P2 (546.0651894)


   

1-[2-[[[[3,4-dihydroxy-3-(hydroxymethyl)-2-methyl-tetrahydrofuran-5-yl]oxy-hydroxy-phosphinoyl]oxy-hydroxy-phosphinoyl]oxymethyl]-3-hydroxy-tetrahydrofuran-5-yl]-5-methyl-1H-pyrimidine-2,4-dione

1-[2-[[[[3,4-dihydroxy-3-(hydroxymethyl)-2-methyl-tetrahydrofuran-5-yl]oxy-hydroxy-phosphinoyl]oxy-hydroxy-phosphinoyl]oxymethyl]-3-hydroxy-tetrahydrofuran-5-yl]-5-methyl-1H-pyrimidine-2,4-dione

C16H24N2O15P2-2 (546.0651894)


   

dTDP-4-amino-4,6-dideoxy-D-galactose(1-)

dTDP-4-amino-4,6-dideoxy-D-galactose(1-)

C16H26N3O14P2- (546.0889976)


   

Thymidine 5-diphospo-6-deoxy-alpha-D-glucopyranoside

Thymidine 5-diphospo-6-deoxy-alpha-D-glucopyranoside

C16H24N2O15P2-2 (546.0651894)


   

dTDP-4-amino-4,6-dideoxy-beta-D-galactose

dTDP-4-amino-4,6-dideoxy-beta-D-galactose

C16H26N3O14P2- (546.0889976)


   

(2S,3R,5R)-3-hydroxy-5-[hydroxy-[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxy-2-methyloxolane-3-carboxylic acid

(2S,3R,5R)-3-hydroxy-5-[hydroxy-[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxy-2-methyloxolane-3-carboxylic acid

C16H24N2O15P2 (546.0651894)


   

7-{[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-8-oxo-3-(pyridinium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

7-{[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-8-oxo-3-(pyridinium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

C22H22N6O7S2 (546.0991342)


   

Ethyl 5-oxo-4-[(4-sulfO-1-naphthyl)azo]-1-(P-sulfophenyl)-2-pyrazoline-3-carboxylate, 8ci

Ethyl 5-oxo-4-[(4-sulfO-1-naphthyl)azo]-1-(P-sulfophenyl)-2-pyrazoline-3-carboxylate, 8ci

C22H18N4O9S2 (546.0515178)


   

Rhythmy

Rhythmy

C21H25Cl3N6O5 (546.095193)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives

   

dTDP-4-dehydro-6-deoxy-L-mannose

dTDP-4-dehydro-6-deoxy-L-mannose

C16H24N2O15P2 (546.0651894)


A dTDP-sugar having 4-dehydro-6-deoxy-L-mannose as the sugar portion.

   
   
   

dTDP-4-amino-4,6-dideoxy-D-glucose

dTDP-4-amino-4,6-dideoxy-D-glucose

C16H26N3O14P2- (546.0889976)


   

methyl N-(2,6-dichlorobenzyl)-3-[2-(2,6-dichlorophenyl)-6-quinolyl]-N-methylalaninate

methyl N-(2,6-dichlorobenzyl)-3-[2-(2,6-dichlorophenyl)-6-quinolyl]-N-methylalaninate

C27H22Cl4N2O2 (546.0435312000001)


   

Dilithium 5-carboxy-2-(3,6-diamino-4,5-disulfonatoxanthenium-9-yl)benzoate

Dilithium 5-carboxy-2-(3,6-diamino-4,5-disulfonatoxanthenium-9-yl)benzoate

C21H12Li2N2O11S2 (546.0202622)


   

Dilithium 4-carboxy-2-(3,6-diamino-4,5-disulfonatoxanthenium-9-yl)benzoate

Dilithium 4-carboxy-2-(3,6-diamino-4,5-disulfonatoxanthenium-9-yl)benzoate

C21H12Li2N2O11S2 (546.0202622)


   

TDP-actinospectose

TDP-actinospectose

C16H24N2O15P2 (546.0651894)


A TDP-sugar having actinospectose as the sugar component.

   
   
   
   

dTDP-4-dehydro-6-deoxy-beta-D-gulose

dTDP-4-dehydro-6-deoxy-beta-D-gulose

C16H24N2O15P2 (546.0651894)


   

UDP-4-dehydro-6-deoxy-D-glucose(2-)

UDP-4-dehydro-6-deoxy-D-glucose(2-)

C15H20N2O16P2-2 (546.028806)


   
   
   

1-{[(6R,7R)-2-carboxy-7-[(2Z)-2-[(1-carboxylato-1-methylethoxy)imino]-2-(2-imino-2,3-dihydro-1,3-thiazol-4-yl)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}pyridin-1-ium

1-{[(6R,7R)-2-carboxy-7-[(2Z)-2-[(1-carboxylato-1-methylethoxy)imino]-2-(2-imino-2,3-dihydro-1,3-thiazol-4-yl)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}pyridin-1-ium

C22H22N6O7S2 (546.0991342)


   
   

dTDP-4-oxo-6-deoxy-D-glucose

dTDP-4-dehydro-6-deoxy-alpha-D-glucopyranose

C16H24N2O15P2 (546.0651894)


A dTDP-sugar having 4-dehydro-6-deoxy-alpha-D-glucose as the sugar component. It is an intermediate in dTDP-rhamnose biosynthesis.

   

dTDP-6-deoxy-beta-L-mannose(2-)

dTDP-6-deoxy-beta-L-mannose(2-)

C16H24N2O15P2 (546.0651894)


Dianion of dTDP-6-deoxy-beta-L-mannose arising from deprotonation of both free OH groups of the diphosphate.

   

dTDP-beta-D-fucofuranose(2-)

dTDP-beta-D-fucofuranose(2-)

C16H24N2O15P2 (546.0651894)


A nucleotide-sugar oxoanion arising from deprotonation of the free diphosphate OH groups of dTDP-beta-D-fucofuranose.

   

dTDP-L-rhamnose(2-)

dTDP-L-rhamnose(2-)

C16H24N2O15P2 (546.0651894)


A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of dTDP-L-rhamnose; major species at pH 7.3.

   

dTDP-4-oxo-6-deoxy-D-allose

dTDP-4-oxo-6-deoxy-D-allose

C16H24N2O15P2 (546.0651894)


   

2,3,7-trihydroxy-9-methoxy-4-{2,3,7-trihydroxy-9-methoxy-6-oxobenzo[c]chromen-1-yl}benzo[c]chromen-6-one

2,3,7-trihydroxy-9-methoxy-4-{2,3,7-trihydroxy-9-methoxy-6-oxobenzo[c]chromen-1-yl}benzo[c]chromen-6-one

C28H18O12 (546.0798228)


   

3-O-methyl-6-deoxy-D-allose

NA

C16H24N2O15P2 (546.0651894)


{"Ingredient_id": "HBIN009337","Ingredient_name": "3-O-methyl-6-deoxy-D-allose","Alias": "NA","Ingredient_formula": "C16H24N2O15P2","Ingredient_Smile": "CC1C(=O)C(C(C(O1)OP(=O)(O)OP(=O)(O)OCC2C(CC(O2)N3C=C(C(=O)NC3=O)C)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39045","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4'-o-methylellagicacid 3-(2'',3''-di-o-acetyl)-α-l-rhamnoside

NA

C25H22O14 (546.1009512)


{"Ingredient_id": "HBIN010778","Ingredient_name": "4'-o-methylellagicacid 3-(2'',3''-di-o-acetyl)-\u03b1-l-rhamnoside","Alias": "NA","Ingredient_formula": "C25H22O14","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14335","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2,3,7-trihydroxy-9-methoxy-1-{2,3,7-trihydroxy-9-methoxy-6-oxobenzo[c]chromen-1-yl}benzo[c]chromen-6-one

2,3,7-trihydroxy-9-methoxy-1-{2,3,7-trihydroxy-9-methoxy-6-oxobenzo[c]chromen-1-yl}benzo[c]chromen-6-one

C28H18O12 (546.0798228)


   

4-hydroxy-9,10-dioxo-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-{[(3-methoxy-3-oxopropanoyl)oxy]methyl}oxan-2-yl]oxy}anthracene-2-carboxylic acid

4-hydroxy-9,10-dioxo-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-{[(3-methoxy-3-oxopropanoyl)oxy]methyl}oxan-2-yl]oxy}anthracene-2-carboxylic acid

C25H22O14 (546.1009512)


   

1-{[(6r,7r)-2-carboxy-7-{[(2z)-2-[(1-carboxylato-1-methylethoxy)imino]-1-hydroxy-2-(2-imino-3h-1,3-thiazol-4-yl)ethylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}pyridin-1-ium

1-{[(6r,7r)-2-carboxy-7-{[(2z)-2-[(1-carboxylato-1-methylethoxy)imino]-1-hydroxy-2-(2-imino-3h-1,3-thiazol-4-yl)ethylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}pyridin-1-ium

C22H22N6O7S2 (546.0991342)


   

(2s,3r,4r,5s,6s)-3-(acetyloxy)-2-({6,14-dihydroxy-13-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-5-hydroxy-6-methyloxan-4-yl acetate

(2s,3r,4r,5s,6s)-3-(acetyloxy)-2-({6,14-dihydroxy-13-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-5-hydroxy-6-methyloxan-4-yl acetate

C25H22O14 (546.1009512)


   

(2s,3r,4s,5r,6s)-6-{[(2s,3r,4r,5r,6s)-2-carboxy-6-{[(2s,3r,4r,5r,6s)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy}-4,5-dihydroxyoxan-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

(2s,3r,4s,5r,6s)-6-{[(2s,3r,4r,5r,6s)-2-carboxy-6-{[(2s,3r,4r,5r,6s)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy}-4,5-dihydroxyoxan-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H26O19 (546.1068246)


   

4,5,6-trihydroxy-2-(hydroxymethyl)-9-[4,5,6-trihydroxy-2-(hydroxymethyl)-8-oxocyclohexa[g]chromen-9-yl]cyclohexa[g]chromen-8-one

4,5,6-trihydroxy-2-(hydroxymethyl)-9-[4,5,6-trihydroxy-2-(hydroxymethyl)-8-oxocyclohexa[g]chromen-9-yl]cyclohexa[g]chromen-8-one

C28H18O12 (546.0798228)


   

3-(acetyloxy)-2-({6,14-dihydroxy-13-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-5-hydroxy-6-methyloxan-4-yl acetate

3-(acetyloxy)-2-({6,14-dihydroxy-13-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-5-hydroxy-6-methyloxan-4-yl acetate

C25H22O14 (546.1009512)


   

(3r)-8-[(3r)-9,10-dihydroxy-3-methyl-1,6,7-trioxo-3h,4h-naphtho[2,3-c]pyran-8-yl]-9,10-dihydroxy-3-methyl-3h,4h-naphtho[2,3-c]pyran-1,6,7-trione

(3r)-8-[(3r)-9,10-dihydroxy-3-methyl-1,6,7-trioxo-3h,4h-naphtho[2,3-c]pyran-8-yl]-9,10-dihydroxy-3-methyl-3h,4h-naphtho[2,3-c]pyran-1,6,7-trione

C28H18O12 (546.0798228)


   

4-hydroxy-9,10-dioxo-5-[(3,4,5-trihydroxy-6-{[(3-methoxy-3-oxopropanoyl)oxy]methyl}oxan-2-yl)oxy]anthracene-2-carboxylic acid

4-hydroxy-9,10-dioxo-5-[(3,4,5-trihydroxy-6-{[(3-methoxy-3-oxopropanoyl)oxy]methyl}oxan-2-yl)oxy]anthracene-2-carboxylic acid

C25H22O14 (546.1009512)


   

6-({2-carboxy-6-[(2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-({2-carboxy-6-[(2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H26O19 (546.1068246)


   

[(2r,5r)-3,5-dihydroxy-6-methyl-4-oxooxan-2-yl]oxy([hydroxy([(2r,3s,5r)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy)phosphoryl]oxy)phosphinic acid

[(2r,5r)-3,5-dihydroxy-6-methyl-4-oxooxan-2-yl]oxy([hydroxy([(2r,3s,5r)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy)phosphoryl]oxy)phosphinic acid

C16H24N2O15P2 (546.0651894)


   

8-{6,7-dihydroxy-3-methyl-1,9,10-trioxo-3h,4h-naphtho[1,2-c]pyran-8-yl}-6,7-dihydroxy-3-methyl-3h,4h-naphtho[1,2-c]pyran-1,9,10-trione

8-{6,7-dihydroxy-3-methyl-1,9,10-trioxo-3h,4h-naphtho[1,2-c]pyran-8-yl}-6,7-dihydroxy-3-methyl-3h,4h-naphtho[1,2-c]pyran-1,9,10-trione

C28H18O12 (546.0798228)