(2S,4R)-Pentane-1,2,3,4,5-Pentol
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL1865120 | |
| PubChem: | 6912 | |
| IUPAC: | (2S,4R)-pentane-1,2,3,4,5-pentol | |
| Standard InChI: | InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5? | |
| Standard InChI Key: | HEBKCHPVOIAQTA-NGQZWQHPSA-N | |
| SMILES: | OC[C@H](C([C@H](CO)O)O)O | |
Molecular propeties
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| AlogP: | -2.95 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 5 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 0 | |
| Molecular Weight: | 152.07 | |
| Topological polar surface area: | 101 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 1 | |
| Number of carbons: | 5 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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