Ethyl glucoside

Details

Top
Internal ID a2f59587-7dd1-4c71-870c-55a61f0af64e
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Glycosyl compounds > O-glycosyl compounds
IUPAC Name 2-ethoxy-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES (Canonical) CCOC1C(C(C(C(O1)CO)O)O)O
SMILES (Isomeric) CCOC1C(C(C(C(O1)CO)O)O)O
InChI InChI=1S/C8H16O6/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8/h4-12H,2-3H2,1H3
InChI Key WYUFTYLVLQZQNH-UHFFFAOYSA-N
Popularity 30 references in papers

Physical and Chemical Properties

Top
Molecular Formula C8H16O6
Molecular Weight 208.21 g/mol
Exact Mass 208.09468823 g/mol
Topological Polar Surface Area (TPSA) 99.40 Ų
XlogP -1.80

Synonyms

Top
Ethyl Alpha-D-Glucoside
2-ethoxy-6-(hydroxymethyl)oxane-3,4,5-triol
3198-49-0
alpha-Ethyl glucoside
Glucopyranoside, ethyl
30285-48-4
Ethyl alpha-D-galactoside;Ethyl alpha-D-galactopyranoside
octyl-d-glucoside
Ethyl D-glucopyranoside; Sucraph AG 6202
SCHEMBL13102153
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

Top
2D Structure of Ethyl glucoside

3D Structure

Top

ADMET Properties (via admetSAR 2)

Top
Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

Top

Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.82% 96.09%
CHEMBL218 P21554 Cannabinoid CB1 receptor 85.45% 96.61%
CHEMBL3401 O75469 Pregnane X receptor 83.35% 94.73%
CHEMBL253 P34972 Cannabinoid CB2 receptor 83.22% 97.25%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 82.86% 91.11%
CHEMBL226 P30542 Adenosine A1 receptor 82.51% 95.93%
CHEMBL3589 P55263 Adenosine kinase 82.26% 98.05%
CHEMBL3137262 O60341 LSD1/CoREST complex 81.22% 97.09%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.31% 99.17%

Plants that contains it

Top
Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Clerodendrum mandarinorum
Euterpe precatoria
Glehnia littoralis
Iris tenuifolia
Justicia adhatoda
Rubus niveus
Salsola collina
Sisyrinchium palmifolium
Tylosema esculentum

Cross-Links

Top
PubChem 428040
LOTUS LTS0028146
wikiData Q104888917