Glucuronic Acid

HCID 65041CAS 576-37-4

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Basic information

Standard SMILES: O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)C(=O)O
InChIKey: IAJILQKETJEXLJ-QTBDOELSSA-N
Molecular formula: C6H10O7
Average molar mass: 194.14 g/mol

Overview

Aldehydo-D-glucuronic acid is a D-glucuronic acid. It is functionally related to an aldehydo-D-glucose. It is a conjugate acid of an aldehydo-D-glucuronate.

Names & identifiers

Preferred name: Glucuronic Acid
IUPAC: (2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid
English name: glucuronic acid
Molecular formula: C6H10O7
Molecular weight: 194.14

Names & synonyms

D-(+)-glucuronic acidGlucuronic acid, D-CHEMBL1235649GLUCURONIC ACID (II)GLUCURONIC ACID [II]D-GLUCURONIC ACID (USP-RS)D-GLUCURONIC ACID [USP-RS]GlyTouCan:G57856MNRefChem:1109594CHEBI:24298G57856MN209-401-7

Show more names

D,L-GalA

(2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid576-37-4DL-Glucuronic acidaldehydo-D-glucuronic acidGlucosiduronic acidDL-GlucuronicacidEINECS 209-401-7EINECS 229-486-4

Database identifiers

CAS: 576-37-4、6556-12-3
PubChem CID: 65041
DTXSID: DTXSID40273973
ChEMBL: CHEMBL1235649
ChEBI: CHEBI:47953
UNII: 8A5D83Q4RW
EC Number: 209-401-7
Nikkaji: J82.112H

Properties

Computed structural properties

XLogP: -2.6
Topological polar surface area: 135 Å²
Hydrogen bond donors: 5
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 13
Formal charge: 0
Complexity: 191

Experimental & physicochemical properties

CosmeticsHumectant; Chelating; Buffering

Collision Cross Section150.1 Å² [M+Na]+

Physicochemical properties

Boiling point: 553.4 · 553.4±50.0 °C(Predicted)
Density: 1.748 · 1.748±0.06 g/cm3(Predicted)
pka: 3.3 · 3.30±0.35(Predicted)
Cosmetics Ingredients Functions: BUFFERINGCHELATINGHUMECTANT
LogP: -1.49 · -1.490 (est)

Safety & regulation

GHS classification

GHS ClassificationNot Classified

Hazard information

Regulatory InformationGlucuronic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesNot Classified

Chemistry & industry

Uses & manufacturing

Use ClassificationCosmetics -> Humectant; Chelating; Buffering

Applications

UsesGlucuronic Acid is a non-steroidal anti-inflammatory drug with immunomodulatory properties.

Suppliers11 total

北京华美互利生物化工010-56205725 · [email protected]

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深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]

陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]

河北贞佳新材料有限公司0319-5925599 13315915972

Additional notes

DefinitionChEBI: Aldehydo-D-glucuronic acid is a D-glucuronic acid. It is functionally related to an aldehydo-D-glucose. It is a conjugate acid of an aldehydo-D-glucuronate.