D-Fucose
PubChem CID: 94270
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| Compound Synonyms | 3615-37-0, D-(+)-Fucose, (2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanal, (+)-fucose, D-Galactose, 6-deoxy-, D(+)-Fucose, aldehydo-D-fucose, Fucose, D-, EINECS 222-792-9, D-FUCOSE [MI], 603I57Y449, CHEBI:48203, DTXSID80883994, MFCD00135603, 6DeoxyDgalactose, DGalactomethylose, UNII-603I57Y449, DGalactose, 6deoxy, D-(+)-Fucose (Standard), SCHEMBL21210, 6-Deoxy-D-galactose, Rhodeose, GTPL4722, CHEMBL3343362, CHEBI:28847, HY-N5102R, D-(+)-Fucose, >=98%, DTXCID801023469, HY-N5102, GEO-01439, AKOS015924852, MF00381, AS-35297, DA-52275, CS-0032367, NS00083126, Rel-(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanal, (2R,3S,4S,5R)-2,3,4,5-tetrakis(oxidanyl)hexanal, Q27077034, 222-792-9 |
|---|---|
| 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 | 4.0 |
| Iupac Name | (2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanal |
| Nih Violation | True |
| Prediction Hob | 1.0 |
| Xlogp | -2.4 |
| Is Pains | False |
| Molecular Formula | C6H12O5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | PNNNRSAQSRJVSB-DPYQTVNSSA-N |
| Fcsp3 | 0.8333333333333334 |
| Rotatable Bond Count | 4.0 |
| Compound Name | D-Fucose |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 164.068 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| 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/t3-,4+,5+,6-/m1/s1 |
| Smiles | C[C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Allium Chinense (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Allium Macrostemon (Plant) Rel Props:Source_db:cmaup_ingredients