aldehydo-D-talose

Details

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Internal ID c9ba7a81-1164-43fa-9707-3a58b7b6978e
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Monosaccharides > Hexoses
IUPAC Name (2S,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal
SMILES (Canonical) C(C(C(C(C(C=O)O)O)O)O)O
SMILES (Isomeric) C([C@H]([C@@H]([C@@H]([C@@H](C=O)O)O)O)O)O
InChI InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4-,5-,6+/m1/s1
InChI Key GZCGUPFRVQAUEE-KAZBKCHUSA-N
Popularity 301 references in papers

Physical and Chemical Properties

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Molecular Formula C6H12O6
Molecular Weight 180.16 g/mol
Exact Mass 180.06338810 g/mol
Topological Polar Surface Area (TPSA) 118.00 Ų
XlogP -2.90

Synonyms

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D-(+)-Talose
aldehydo-D-talose
(2S,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal
8ZW23G7NVD
NSC-224293
EINECS 219-996-5
TALOSE, D-
UNII-8ZW23G7NVD
SCHEMBL37336
CHEBI:68461
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of aldehydo-D-talose

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
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 85.90% 97.29%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.60% 96.09%
CHEMBL2581 P07339 Cathepsin D 81.71% 98.95%
CHEMBL3145 P42338 PI3-kinase p110-beta subunit 80.49% 98.75%

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.
Pogostemon cablin

Cross-Links

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PubChem 99459
LOTUS LTS0175905
wikiData Q423195