Germicidin N

Details

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Internal ID 04223e23-3c7b-4404-a567-065f8225b838
Taxonomy Organoheterocyclic compounds > Pyrans > Pyranones and derivatives
IUPAC Name 3-ethyl-4-hydroxy-6-[(2S,3R)-3-hydroxybutan-2-yl]pyran-2-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C11H16O4/c1-4-8-9(13)5-10(15-11(8)14)6(2)7(3)12/h5-7,12-13H,4H2,1-3H3/t6-,7+/m0/s1
InChI Key JZKQRLWNCLOAGQ-NKWVEPMBSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C11H16O4
Molecular Weight 212.24 g/mol
Exact Mass 212.10485899 g/mol
Topological Polar Surface Area (TPSA) 66.80 Ų
XlogP 1.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Germicidin N

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
CHEMBL2581 P07339 Cathepsin D 96.58% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 93.87% 91.11%
CHEMBL3401 O75469 Pregnane X receptor 93.85% 94.73%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 89.24% 90.71%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 88.56% 89.34%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.39% 95.56%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 87.00% 94.45%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.97% 86.33%
CHEMBL1806 P11388 DNA topoisomerase II alpha 81.86% 89.00%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 80.19% 86.92%

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 146684238
LOTUS LTS0175705
wikiData Q105137441