1,5-Anhydro-D-fructose

Details

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Internal ID 5188e337-6950-4069-b2cb-e9bcea7bc61d
Taxonomy Organoheterocyclic compounds > Oxanes
IUPAC Name (4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-one
SMILES (Canonical) C1C(=O)C(C(C(O1)CO)O)O
SMILES (Isomeric) C1C(=O)[C@H]([C@@H]([C@H](O1)CO)O)O
InChI InChI=1S/C6H10O5/c7-1-4-6(10)5(9)3(8)2-11-4/h4-7,9-10H,1-2H2/t4-,5-,6-/m1/s1
InChI Key OCLOLUFOLJIQDC-HSUXUTPPSA-N
Popularity 72 references in papers

Physical and Chemical Properties

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Molecular Formula C6H10O5
Molecular Weight 162.14 g/mol
Exact Mass 162.05282342 g/mol
Topological Polar Surface Area (TPSA) 87.00 Ų
XlogP -1.60

Synonyms

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75414-43-6
1,5-Anhydrofructose
CHEBI:16715
(4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-one
CHEMBL1234723
AC1Q6ETX
NHF
1,5-Anhydrohex-2-ulose
SureCN246685
D-Fructose, 1:5-anhydro-
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 1,5-Anhydro-D-fructose

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.75% 91.11%
CHEMBL3137262 O60341 LSD1/CoREST complex 88.76% 97.09%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.81% 96.09%
CHEMBL226 P30542 Adenosine A1 receptor 86.15% 95.93%
CHEMBL2581 P07339 Cathepsin D 84.84% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 81.35% 95.56%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.77% 100.00%
CHEMBL1806 P11388 DNA topoisomerase II alpha 80.43% 89.00%

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 126517
LOTUS LTS0077869
wikiData Q27102040