[(2R,3S,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate

Details

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Internal ID 57c775ce-0a67-4047-861e-bb413f5f5ca5
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Monosaccharides > Monosaccharide phosphates
IUPAC Name [(2R,3S,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C6H14NO8P/c7-3-5(10)4(9)2(1-8)14-6(3)15-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3+,4-,5-,6-/m1/s1
InChI Key YMJBYRVFGYXULK-AIECOIEWSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C6H14NO8P
Molecular Weight 259.15 g/mol
Exact Mass 259.04570340 g/mol
Topological Polar Surface Area (TPSA) 163.00 Ų
XlogP -6.20

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of [(2R,3S,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate

3D Structure

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ADMET Properties (via admetSAR 2)

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

Targets

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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 95.57% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 92.29% 97.29%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 91.48% 86.92%
CHEMBL3230 O95977 Sphingosine 1-phosphate receptor Edg-6 90.26% 94.01%
CHEMBL3137262 O60341 LSD1/CoREST complex 88.96% 97.09%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 86.54% 94.45%
CHEMBL226 P30542 Adenosine A1 receptor 85.39% 95.93%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 83.52% 91.11%
CHEMBL3286 P00749 Urokinase-type plasminogen activator 81.06% 97.88%
CHEMBL3401 O75469 Pregnane X receptor 81.04% 94.73%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 93126123
LOTUS LTS0209156
wikiData Q105350565