4-hydroxymethyl-2-methyl-3-furanylcarbonyl alpha-L-rhamnopyranoside

Details

• Internal ID: a1e2b2e9-9526-4a37-bf87-8fb815d593af
• Taxonomy: Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Monosaccharides > Hexoses
• IUPAC Name: [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] 4-(hydroxymethyl)-2-methylfuran-3-carboxylate
• InChI: InChI=1S/C13H18O8/c1-5-8(7(3-14)4-19-5)12(18)21-13-11(17)10(16)9(15)6(2)20-13/h4,6,9-11,13-17H,3H2,1-2H3/t6-,9-,10+,11+,13-/m0/s1
• InChI Key: XEBULAHYBZLGDT-PGRGYFNBSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₃H₁₈O₈
• Molecular Weight: 302.28 g/mol
• Exact Mass: 302.10016753 g/mol
• Topological Polar Surface Area (TPSA): 130.00 Ų
• XlogP: -1.30

Synonyms

There are no found synonyms.

2D Structure

ADMET Properties (via admetSAR 2)

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

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL3714130	P46095	G-protein coupled receptor 6	96.18%	97.36%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	95.25%	96.09%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	94.75%	91.11%
CHEMBL3401	O75469	Pregnane X receptor	93.57%	94.73%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	88.00%	94.00%
CHEMBL1293249	Q13887	Kruppel-like factor 5	87.66%	86.33%
CHEMBL1806	P11388	DNA topoisomerase II alpha	85.81%	89.00%
CHEMBL2581	P07339	Cathepsin D	85.47%	98.95%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	84.57%	96.00%
CHEMBL3060	Q9Y345	Glycine transporter 2	84.18%	99.17%
CHEMBL253	P34972	Cannabinoid CB2 receptor	83.59%	97.25%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 10542376
• LOTUS: LTS0170954
• wikiData: Q77280677