6-Deoxyhexose
PubChem CID: 220001
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| Compound Synonyms | 6-Deoxyhexose, 2,3,4,5-tetrahydroxyhexanal, D-(+)-Fucose, 3615-41-6, L(+)-Rhamnose, 75247-25-5, NSC2056, DTXSID701019213, 6-Deoxy-L-altrose, NSC-2056, MFCD00135603, 6-Deoxygalactose, D-Galactomethylose, D-6-Deoxygalactose, Rhamnopyranose, L-, 6-Deoxy-l-galactos, RHAMNOSE (L), SCHEMBL466429, DTXCID30199138, STL280415, AKOS016355754, LS-13184, MD163281, MD170585, MD170586, SY024013, SY112105, CS-0278475, NS00014037, EN300-381132, 31983709-E12F-467D-A73E-4A6FCDE56899 |
|---|---|
| Topological Polar Surface Area | 98.0 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 126.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,3,4,5-tetrahydroxyhexanal |
| Prediction Hob | 1.0 |
| Xlogp | -2.4 |
| Molecular Formula | C6H12O5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | PNNNRSAQSRJVSB-UHFFFAOYSA-N |
| Fcsp3 | 0.8333333333333334 |
| Logs | -0.015 |
| Rotatable Bond Count | 4.0 |
| Logd | -1.995 |
| Compound Name | 6-Deoxyhexose |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 164.068 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 164.068 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 164.16 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 4.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 0.9056265999999997 |
| Inchi | InChI=1S/C6H12O5/c1-3(8)5(10)6(11)4(9)2-7/h2-6,8-11H,1H3 |
| Smiles | CC(C(C(C(C=O)O)O)O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Pogostemon Cablin (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Tephrosia Purpurea (Plant) Rel Props:Source_db:cmaup_ingredients