Ganodermalactone K

Details

Top
Internal ID bf539c0e-9868-419f-a607-dcf443661865
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Triterpenoids
IUPAC Name [(1R,2S,8R,12R,15R,16R,18R)-7,7,12,16-tetramethyl-15-[(1S)-1-[(2S)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5-oxo-6,19-dioxapentacyclo[9.8.0.01,18.02,8.012,16]nonadec-10-en-2-yl]methyl acetate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C32H44O7/c1-18-8-9-22(37-27(18)35)19(2)21-12-14-29(6)24-11-10-23-28(4,5)39-26(34)13-15-31(23,17-36-20(3)33)32(24)25(38-32)16-30(21,29)7/h8,11,19,21-23,25H,9-10,12-17H2,1-7H3/t19-,21+,22-,23-,25+,29-,30+,31+,32-/m0/s1
InChI Key FYIANMAHJHGDPG-XRUYFVBTSA-N
Popularity 2 references in papers

Physical and Chemical Properties

Top
Molecular Formula C32H44O7
Molecular Weight 540.70 g/mol
Exact Mass 540.30870374 g/mol
Topological Polar Surface Area (TPSA) 91.40 Ų
XlogP 5.00

Synonyms

Top
There are no found synonyms.

2D Structure

Top
2D Structure of Ganodermalactone K

3D Structure

Top

ADMET Properties (via admetSAR 2)

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

Targets

Top

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
CHEMBL253 P34972 Cannabinoid CB2 receptor 98.40% 97.25%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 96.21% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.65% 96.09%
CHEMBL2581 P07339 Cathepsin D 92.50% 98.95%
CHEMBL1937 Q92769 Histone deacetylase 2 92.46% 94.75%
CHEMBL2782 P35610 Acyl coenzyme A:cholesterol acyltransferase 1 92.26% 91.65%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 90.95% 94.45%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.57% 95.56%
CHEMBL1806 P11388 DNA topoisomerase II alpha 87.81% 89.00%
CHEMBL3137262 O60341 LSD1/CoREST complex 86.72% 97.09%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 86.04% 99.23%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 85.89% 97.14%
CHEMBL3359 P21462 Formyl peptide receptor 1 83.05% 93.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.99% 86.33%
CHEMBL2007 P16234 Platelet-derived growth factor receptor alpha 82.75% 91.07%
CHEMBL5028 O14672 ADAM10 81.70% 97.50%
CHEMBL5608 Q16288 NT-3 growth factor receptor 80.63% 95.89%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 80.61% 94.00%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 80.41% 92.62%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.29% 100.00%

Plants that contains it

Top
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

Top
PubChem 145720873
LOTUS LTS0216689
wikiData Q105004489