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Sugar acids and derivatives

Monosacharides with a carboxyl group at one or both ends of their chain; includes aldonic, ulosonic, uronic, and aldaric acids; may act as sequestering agents and binders, corrosion inhibitors, biodegradable chelators for pharmaceuticals, or pH regulators.
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Keyword Search:
1 – 15 of 44 results
1

Calcium Saccharate Tetrahydrate, TRC

CAS: 5793-89-5 Molecular Formula: C6 H8 O8 . Ca . 4 H2 O Molecular Weight (g/mol): 320.26 IUPAC Name: calcium;(2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate;tetrahydrate SMILES: O.O.O.O.[Ca+2].O[C@@H]([C@H](O)[C@H](O)C(=O)[O-])[C@@H](O)C(=O)[O-]

CAS 5793-89-5
Molecular Weight (g/mol) 320.26
SMILES O.O.O.O.[Ca+2].O[C@@H]([C@H](O)[C@H](O)C(=O)[O-])[C@@H](O)C(=O)[O-]
IUPAC Name calcium;(2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate;tetrahydrate
Molecular Formula C6 H8 O8 . Ca . 4 H2 O
2

D-Glucuronic Acid, TRC

CAS: 6556-12-3 Molecular Formula: C6 H10 O7 Molecular Weight (g/mol): 194.14 Synonym: D-Glucuronic Acid,Glucuronic acid, D- (8CI),D-(+)-Glucuronic acid,Glucosiduronic acid,Glucuronic acid IUPAC Name: (2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid SMILES: O[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)C(=O)O

CAS 6556-12-3
Molecular Weight (g/mol) 194.14
SMILES O[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)C(=O)O
Synonym D-Glucuronic Acid,Glucuronic acid, D- (8CI),D-(+)-Glucuronic acid,Glucosiduronic acid,Glucuronic acid
IUPAC Name (2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid
Molecular Formula C6 H10 O7
3

Sodium Chondroitin Sulfate A, TRC

CAS: 39455-18-0 Molecular Formula: (C14 H19 N O14 S . x Na)n Molecular Weight (g/mol): 463.37 Synonym: Sodium chondroitin 4-sulfate SMILES: [Na+].[*]O[C@H]1[C@H](O)[C@@H](O)[C@H](O[C@@H]2[C@@H](NC(=O)C)[C@H]([*])O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])O[C@@H]1C(=O)O

CAS 39455-18-0
Molecular Weight (g/mol) 463.37
SMILES [Na+].[*]O[C@H]1[C@H](O)[C@@H](O)[C@H](O[C@@H]2[C@@H](NC(=O)C)[C@H]([*])O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])O[C@@H]1C(=O)O
Synonym Sodium chondroitin 4-sulfate
Molecular Formula (C14 H19 N O14 S . x Na)n
4

Propyl Beta-D-Glucuronide, TRC

CAS: 17685-07-3 Molecular Formula: C9 H16 O7 Molecular Weight (g/mol): 236.22 Synonym: Propyl β-D-Glucopyranosiduronic Acid; IUPAC Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-propoxyoxane-2-carboxylic acid SMILES: CCCO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O

CAS 17685-07-3
Molecular Weight (g/mol) 236.22
SMILES CCCO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O
Synonym Propyl β-D-Glucopyranosiduronic Acid;
IUPAC Name (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-propoxyoxane-2-carboxylic acid
Molecular Formula C9 H16 O7
6

Ethyl Beta-D-Glucuronide, TRC

CAS: 17685-04-0 Molecular Formula: C8 H14 O7 Molecular Weight (g/mol): 222.193 Synonym: β-D-Glucopyranosiduronic acid, ethyl (9CI, ACI),Ethyl β-D-glucopyranosiduronic acid (ACI),Glucopyranosiduronic acid, ethyl, β-D- (6CI, 8CI),BA 2829,Ethyl glucuronide,Ethyl β-D-glucosiduronic acid,Ethyl β-D-glucuronide IUPAC Name: (2S,3S,4S,5R,6R)-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid SMILES: CCO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O

CAS 17685-04-0
Molecular Weight (g/mol) 222.193
SMILES CCO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O
Synonym β-D-Glucopyranosiduronic acid, ethyl (9CI, ACI),Ethyl β-D-glucopyranosiduronic acid (ACI),Glucopyranosiduronic acid, ethyl, β-D- (6CI, 8CI),BA 2829,Ethyl glucuronide,Ethyl β-D-glucosiduronic acid,Ethyl β-D-glucuronide
IUPAC Name (2S,3S,4S,5R,6R)-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Formula C8 H14 O7
7

Bumetanide Beta-D-Glucuronide, TRC

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8

Monooctyl Phthalate Beta-D-Glucuronide, TRC

Molecular Formula: C22H30O10 Molecular Weight (g/mol): 454.47 SMILES: O=C(O[C@@H](C1O)O[C@H](C(O)=O)[C@@H](O)C1O)C2=CC=CC=C2C(OCCCCCCCC)=O

Molecular Weight (g/mol) 454.47
SMILES O=C(O[C@@H](C1O)O[C@H](C(O)=O)[C@@H](O)C1O)C2=CC=CC=C2C(OCCCCCCCC)=O
Molecular Formula C22H30O10
9

Diclofenac Acyl-Beta-D-glucuronide, TRC

CAS: 64118-81-6 Molecular Formula: C20 H19 Cl2 N O8 Molecular Weight (g/mol): 472.27 Synonym: β-D-Glucopyranuronic acid, 1-[2-[(2,6-dichlorophenyl)amino]benzeneacetate],Diclofenac glucuronide,Diclofenac-β-D-glucuronide IUPAC Name: (2S,3S,4S,5R,6S)-6-[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid SMILES: O[C@@H]1[C@@H](O)[C@H](OC(=O)Cc2ccccc2Nc3c(Cl)cccc3Cl)O[C@@H]([C@H]1O)C(=O)O

CAS 64118-81-6
Molecular Weight (g/mol) 472.27
SMILES O[C@@H]1[C@@H](O)[C@H](OC(=O)Cc2ccccc2Nc3c(Cl)cccc3Cl)O[C@@H]([C@H]1O)C(=O)O
Synonym β-D-Glucopyranuronic acid, 1-[2-[(2,6-dichlorophenyl)amino]benzeneacetate],Diclofenac glucuronide,Diclofenac-β-D-glucuronide
IUPAC Name (2S,3S,4S,5R,6S)-6-[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Formula C20 H19 Cl2 N O8
10

Nicotine N-Beta-D-Glucuronide, TRC

CAS: 153536-53-9 Molecular Formula: C16 H22 N2 O6 Molecular Weight (g/mol): 338.36 Synonym: Pyridinium, 1-β-D-glucopyranuronosyl-3-[(2S)-1-methyl-2-pyrrolidinyl]-, inner salt,Pyridinium, 1-β-D-glucopyranuronosyl-3-(1-methyl-2-pyrrolidinyl)-, inner salt, (S)-,Nicotine N-glucuronide,Nicotine N-β-D-Glucuronide IUPAC Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-methylpyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate SMILES: CN1CCC[C@H]1c2ccc[n+](c2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)[O-]

CAS 153536-53-9
Molecular Weight (g/mol) 338.36
SMILES CN1CCC[C@H]1c2ccc[n+](c2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)[O-]
Synonym Pyridinium, 1-β-D-glucopyranuronosyl-3-[(2S)-1-methyl-2-pyrrolidinyl]-, inner salt,Pyridinium, 1-β-D-glucopyranuronosyl-3-(1-methyl-2-pyrrolidinyl)-, inner salt, (S)-,Nicotine N-glucuronide,Nicotine N-β-D-Glucuronide
IUPAC Name (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-methylpyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate
Molecular Formula C16 H22 N2 O6
11

Monobenzyl Phthalate Beta-D-Glucuronide, TRC

CAS: 102674-29-3 Molecular Formula: C21H20O10 Molecular Weight (g/mol): 432.38 Synonym: β-D-Glucopyranuronic acid 1-[2-(Phenylmethyl) 1,2-Benzenedicarboxylate] SMILES: O=C(O[C@@H]([C@@H]1O)O[C@H](C(O)=O)[C@@H](O)[C@@H]1O)C2=CC=CC=C2C(OCC3=CC=CC=C3)=O

CAS 102674-29-3
Molecular Weight (g/mol) 432.38
SMILES O=C(O[C@@H]([C@@H]1O)O[C@H](C(O)=O)[C@@H](O)[C@@H]1O)C2=CC=CC=C2C(OCC3=CC=CC=C3)=O
Synonym β-D-Glucopyranuronic acid 1-[2-(Phenylmethyl) 1,2-Benzenedicarboxylate]
Molecular Formula C21H20O10
12

Ibufenac Acyl-Beta-D-Glucuronide, TRC

CAS: 164669-89-0 Molecular Formula: C18H24O8 Molecular Weight (g/mol): 368.38 Synonym: β-D-Glucopyranuronic acid 1-[4-(2-methylpropyl)benzeneacetate] SMILES: O=C(CC1=CC=C(CC(C)C)C=C1)O[C@H]([C@@H]2O)OC(C(O)=O)[C@@H](O)[C@@H]2O

CAS 164669-89-0
Molecular Weight (g/mol) 368.38
SMILES O=C(CC1=CC=C(CC(C)C)C=C1)O[C@H]([C@@H]2O)OC(C(O)=O)[C@@H](O)[C@@H]2O
Synonym β-D-Glucopyranuronic acid 1-[4-(2-methylpropyl)benzeneacetate]
Molecular Formula C18H24O8
13

Febuxostat Acyl-Beta-D-glucuronide, TRC

CAS: 1351692-92-6 Molecular Formula: C22 H24 N2 O9 S Molecular Weight (g/mol): 492.5 Synonym: 2-[3-Cyano-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylate β-D-Glucopyranuronic Acid,2-(3-Cyano-4-isobutyloxyphenyl)-4-methyl- 5-thiazolecarboxylate β-D-Glucopyranuronic Acid IUPAC Name: (2S,3S,4S,5R,6S)-6-[2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid SMILES: CC(C)COc1ccc(cc1C#N)c2nc(C)c(s2)C(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O

CAS 1351692-92-6
Molecular Weight (g/mol) 492.5
SMILES CC(C)COc1ccc(cc1C#N)c2nc(C)c(s2)C(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O
Synonym 2-[3-Cyano-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylate β-D-Glucopyranuronic Acid,2-(3-Cyano-4-isobutyloxyphenyl)-4-methyl- 5-thiazolecarboxylate β-D-Glucopyranuronic Acid
IUPAC Name (2S,3S,4S,5R,6S)-6-[2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Formula C22 H24 N2 O9 S
14

Furosemide Acyl-Beta-D-glucuronide, TRC

CAS: 72967-59-0 Molecular Formula: C18 H19 Cl N2 O11 S Molecular Weight (g/mol): 506.87 Synonym: β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate],Furosemide glucuronide,Furosemide Acyl-β-D-glucuronide IUPAC Name: (2S,3S,4S,5R,6S)-6-[4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid SMILES: NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c(NCc3occc3)cc1Cl

CAS 72967-59-0
Molecular Weight (g/mol) 506.87
SMILES NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c(NCc3occc3)cc1Cl
Synonym β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate],Furosemide glucuronide,Furosemide Acyl-β-D-glucuronide
IUPAC Name (2S,3S,4S,5R,6S)-6-[4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Formula C18 H19 Cl N2 O11 S
15

L-Idaric Acid Disodium Salt, TRC

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Molecular Weight (g/mol) 254.102
InChI Formula InChI=1S/C6H10O8.2Na/c7-1(3(9)5(11)12)2(8)4(10)6(13)14;;/h1-4,7-10H,(H,11,12)(H,13,14);;/q;2*+1/p-2/t1-,2-,3+,4+;;/m0../s1
Chemical Name or Material L-Idaric Acid Disodium Salt
SMILES O[C@@H]([C@H](O)[C@@H](O)C(=O)O[Na])[C@@H](O)C(=O)O[Na]
Recommended Storage +4°C
IUPAC Name [(2R,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxo-6-sodiooxyhexanoyl]oxysodium
Molecular Formula C6 H8 Na2 O8
Formula Weight 254.001