2-O-(beta-D-glucosyl)glycerol
PubChem CID: 443265
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 10588-30-4, 2-O-(beta-D-glucosyl)glycerol, 2-(beta-Glucosyl)glycerol, 2-(b-Glucosyl)glycerol, 2-(beta-D-Glucopyranosyloxy)-1,3-propanediol, glycerol 2-O-beta-D-glucoside, 2-O-(beta-D-glucosyl)-sn-glycerol, (2R,3R,4S,5S,6R)-2-(1,3-dihydroxypropan-2-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol, 1,3-dihydroxypropan-2-yl beta-D-glucopyranoside, beta,beta'-dihydroxyisopropyl beta-D-glucopyranoside, Lilioside B, 2-(, A-Glucosyl)glycerol, 2-glyceryl beta-D-glucoside, 2-O-beta-d-glucosyl-glycerol, SCHEMBL2300084, CHEBI:17765, DTXSID201219430, sn-glycerol 2-O-beta-D-glucoside, 2-O-(beta-D-glucopyranosyl)-glycerol, G91188, Q27102591, 2-Hydroxy-1-(hydroxymethyl)ethyl I(2)-D-glucopyranoside, WURCS=2.0/2,2,1/[hxh][a2122h-1b_1-5]/1-2/a2-b1, (2R,3R,4S,5S,6R)-2-[(1,3-dihydroxypropan-2-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol, (2R,3R,4S,5S,6R)-2-((1,3-Dihydroxypropan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol |
|---|---|
| Prediction Swissadme | 0.0 |
| Topological Polar Surface Area | 140.0 |
| Hydrogen Bond Donor Count | 6.0 |
| Inchi Key | AQTKXCPRNZDOJU-SYHAXYEDSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 5.0 |
| Heavy Atom Count | 17.0 |
| Compound Name | 2-O-(beta-D-glucosyl)glycerol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 254.1 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 254.1 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 221.0 |
| Hydrogen Bond Acceptor Count | 8.0 |
| Molecular Weight | 254.23 |
| Database Name | cmaup_ingredients;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 5.0 |
| Iupac Name | (2R,3R,4S,5S,6R)-2-(1,3-dihydroxypropan-2-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Prediction Hob | 0.0 |
| Esol | 1.4022430000000006 |
| Inchi | InChI=1S/C9H18O8/c10-1-4(2-11)16-9-8(15)7(14)6(13)5(3-12)17-9/h4-15H,1-3H2/t5-,6-,7+,8-,9-/m1/s1 |
| Smiles | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(CO)CO)O)O)O)O |
| Xlogp | -3.5 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C9H18O8 |
- 1. Outgoing r'ship
FOUND_INto/from Arabidopsis Thaliana (Plant) Rel Props:Source_db:cmaup_ingredients