CNP0131308.2 · C4H6O6 · View on COCONUT ↗
| Name | (+)-L-Tartaric acid |
|---|---|
| IUPAC Name | (2~{R},3~{R})-2,3-dihydroxybutanedioic acid |
| COCONUT ID | CNP0131308.2 |
| CAS | 87-69-4, 133-37-9, 138508-61-9, 144814-09-5, 132517-61-4 |
| InChIKey | FEWJPZIEWOKRBE-JCYAYHJZSA-N |
| InChI | InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1 |
| SMILES | O=C(O)[C@H](O)[C@@H](O)C(=O)O |
| Molecular Formula | C4H6O6 |
|---|---|
| Molecular Weight | 150.09 |
| Exact Mass | 150.01644 |
| Log P (ALogP) | -2.12 |
| TPSA | 115.06 |
| H-Bond Donors / Acceptors | 4 / 4 |
| Rotatable Bonds | 3 |
| Lipinski's Rule of 5 Violations | 0 |
| QED Drug-likeness | 0.37 |
| NP-likeness | 0.66 |
| NP Pathway | Fatty acids |
|---|---|
| NP Superclass | Fatty Acids and Conjugates |
| NP Class | Hydroxy fatty acids |
| Chemical Superclass | Organic acids and derivatives |
| Chemical Class | Hydroxy acids and derivatives |
| Chemical Subclass | Beta hydroxy acids and derivatives |
| Hibiscus rosa-sinensis | as “Hibiscus rosa-sinensis” in COCONUT |
|---|
Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.