beta-D-GLUCOURONIC ACID
PubChem CID: 441478
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| Compound Synonyms | beta-D-Glucopyranuronic acid, beta-D-Glucuronic acid, 23018-83-9, (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid, beta-D-Glucouronic acid, beta-Glucouronic acid, GlcAbeta, GlcAb, beta-D-Glucopyranosyluronic acid, Glucuronic acid, beta-D, UNII-00A9JB14O6, Glucopyranuronic acid, beta-D-, CHEBI:28860, 00A9JB14O6, (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxytetrahydro-2H-pyran-2-carboxylic acid, MFCD00077778, beta-D-GlcpA, D-Gluronic Acid,(S), tetrahydroxytetrahydro-2H, -pyran-2-carboxylic acid, D-Glucuronic acid, 98%, (1S,2S)-Bupropion N-1'-Deoxy-beta-D-glucuronic Acid, SCHEMBL5975, CHEMBL1159524, .BETA.-D-GLUCOURONIC ACID, AEMOLEFTQBMNLQ-QIUUJYRFSA-N, DTXSID801336828, GLUCURONIC ACID, .BETA.-D, STR04776, D-Glucuronic acid, >=98% (GC), AKOS006342973, DB03156, .BETA.-D-GLUCOPYRANOSYLURONIC ACID, GLUCOPYRANURONIC ACID, .BETA.-D-, D-Glucuronic acid, purum, >=97.0% (T), NS00069812, C08350, EN300-106629, F20399, (2S,3S,4S,5R,6R)-3,4,5,6-, Z1201618821, beta-D-glucuronic acid, D-glucuronic acid, glucuronic acid, D-Glucuronic acid, United States Pharmacopeia (USP) Reference Standard, D-Glucuronic Acid, Pharmaceutical Secondary Standard, Certified Reference Material |
|---|---|
| Prediction Swissadme | 0.0 |
| Topological Polar Surface Area | 127.0 |
| Hydrogen Bond Donor Count | 5.0 |
| Inchi Key | AEMOLEFTQBMNLQ-QIUUJYRFSA-N |
| Fcsp3 | 0.8333333333333334 |
| Rotatable Bond Count | 1.0 |
| Heavy Atom Count | 13.0 |
| Compound Name | beta-D-GLUCOURONIC ACID |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 194.043 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 194.043 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 205.0 |
| Hydrogen Bond Acceptor Count | 7.0 |
| Molecular Weight | 194.14 |
| Database Name | cmaup_ingredients;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 5.0 |
| Iupac Name | (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Prediction Hob | 1.0 |
| Esol | -0.051612200000000164 |
| Inchi | InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3+,4-,6+/m0/s1 |
| Smiles | [C@@H]1([C@@H]([C@H](O[C@H]([C@@H]1O)O)C(=O)O)O)O |
| Xlogp | -2.3 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C6H10O7 |
- 1. Outgoing r'ship
FOUND_INto/from Aloe Africana (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Aloe Ferox (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Aloe Spicata (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Aloe Vera (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Panax Ginseng (Plant) Rel Props:Source_db:cmaup_ingredients