Ribocitrin

Details

• Internal ID: 4bf1eeff-50d6-4a02-883b-6260b508f9ae
• Taxonomy: Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Glycosyl compounds > O-glycosyl compounds
• IUPAC Name: 2-[(2R,3R,4S,5R)-4-[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxybutane-1,2,4-tricarboxylic acid
• InChI: InChI=1S/C22H34O19/c23-4-7-12(30)14(32)18(36-7)40-17-13(31)8(5-24)37-20(17)39-16-9(6-25)38-19(15(16)33)41-22(21(34)35,3-11(28)29)2-1-10(26)27/h7-9,12-20,23-25,30-33H,1-6H2,(H,26,27)(H,28,29)(H,34,35)/t7-,8-,9-,12-,13-,14-,15-,16-,17-,18-,19-,20-,22?/m1/s1
• InChI Key: RGAMJCJDWKLDHT-CLHZHDFYSA-N
• Popularity: 3 references in papers

Physical and Chemical Properties

• Molecular Formula: C₂₂H₃₄O₁₉
• Molecular Weight: 602.50 g/mol
• Exact Mass: 602.16942885 g/mol
• Topological Polar Surface Area (TPSA): 309.00 Ų
• XlogP: -5.10

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
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	91.20%	91.11%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	90.41%	96.09%
CHEMBL5255	O00206	Toll-like receptor 4	89.09%	92.50%
CHEMBL3060	Q9Y345	Glycine transporter 2	87.55%	99.17%
CHEMBL2581	P07339	Cathepsin D	85.20%	98.95%
CHEMBL4618	P09960	Leukotriene A4 hydrolase	84.81%	97.86%
CHEMBL218	P21554	Cannabinoid CB1 receptor	82.81%	96.61%
CHEMBL3714130	P46095	G-protein coupled receptor 6	80.30%	97.36%
CHEMBL4016	P42262	Glutamate receptor ionotropic, AMPA 2	80.19%	86.92%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 10100147
• LOTUS: LTS0076123
• wikiData: Q77371495