6-deoxy-D-tagatose

Details

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Internal ID 7be81f70-e049-49df-9b2c-a5a630eed09a
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols
IUPAC Name 1,3,4,5-tetrahydroxyhexan-2-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C6H12O5/c1-3(8)5(10)6(11)4(9)2-7/h3,5-8,10-11H,2H2,1H3
InChI Key QZNPNKJXABGCRC-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C6H12O5
Molecular Weight 164.16 g/mol
Exact Mass 164.06847348 g/mol
Topological Polar Surface Area (TPSA) 98.00 Ų
XlogP -2.20

Synonyms

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6-deoxy-D-tagatose
MFCD34550343
SCHEMBL5958021
TAA54617
MF07931
MD170587
SY286895

2D Structure

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2D Structure of 6-deoxy-D-tagatose

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 95.18% 96.09%
CHEMBL2581 P07339 Cathepsin D 91.47% 98.95%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 87.61% 85.14%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 84.23% 97.29%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 84.14% 100.00%

Plants that contains it

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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.
There are no matching plants.

Cross-Links

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PubChem 841
LOTUS LTS0094336
wikiData Q105232189