(3R)-3-hydroxy-D-aspartic acid
PubChem CID: 11788378
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| Compound Synonyms | 16417-36-0, (3R)-3-hydroxy-D-aspartic acid, (2R,3R)-2-amino-3-hydroxybutanedioic acid, (2R,3R)-2-amino-3-hydroxysuccinic acid, 4294-45-5, (R,R)-3-hydroxyaspartic acid, D-threo-3-hydroxyaspartic acid, threo-D-3-hydroxyaspartic acid, CHEBI:60897, threo-3-hydroxy-D-aspartic acid, D-threo-beta-hydroxyaspartic acid, threo-beta-hydroxy-D-aspartic acid, D,L-threo-beta-Hydroxy Aspartic Acid, D -(+)-THREO -BETA-HYDROXYASPARTIC ACID, (2R,3r)-2-amino-3-hydroxy-succinic acid, D-Aspartic acid, 3-hydroxy-, (3R)-, (2R,3R)-2-amino-3-hydroxysuccinicacid, CHEMBL1256517, DL-Threo-b-HydroxyAspartic acid, SCHEMBL12648656, D,L-Threo-b-hydroxyaspartic acid, Aspartic acid, 3-hydroxy-, threo-, MFCD00036749, AKOS017344538, (2r,3r)-2-amino-3-hydroxy-suc-cinic acid, C19813, Q27129515, 8BC88238-2787-427B-B705-0382A4CDD6D7 |
|---|---|
| Topological Polar Surface Area | 121.0 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 156.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (2R,3R)-2-amino-3-hydroxybutanedioic acid |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | -4.4 |
| Is Pains | False |
| Molecular Formula | C4H7NO5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | YYLQUHNPNCGKJQ-JCYAYHJZSA-N |
| Fcsp3 | 0.5 |
| Rotatable Bond Count | 3.0 |
| Compound Name | (3R)-3-hydroxy-D-aspartic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 149.032 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 149.032 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 149.1 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.6700172000000002 |
| Inchi | InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/t1-,2-/m1/s1 |
| Smiles | [C@@H]([C@H](C(=O)O)O)(C(=O)O)N |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Astragalus Sinicus (Plant) Rel Props:Source_db:cmaup_ingredients