Ethyl ganoderate J

Details

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Internal ID 2226d723-988a-4ab6-9ea3-9e4df7ef3d13
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Triterpenoids
IUPAC Name ethyl (6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,7,11-trioxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C32H46O7/c1-9-39-28(38)18(3)13-19(33)12-17(2)20-14-25(37)32(8)27-21(34)15-23-29(4,5)24(36)10-11-30(23,6)26(27)22(35)16-31(20,32)7/h17-18,20,23,25,37H,9-16H2,1-8H3/t17-,18?,20-,23+,25+,30+,31-,32+/m1/s1
InChI Key MOGCKMACSLYDKK-BQPSBNGHSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C32H46O7
Molecular Weight 542.70 g/mol
Exact Mass 542.32435380 g/mol
Topological Polar Surface Area (TPSA) 115.00 Ų
XlogP 3.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Ethyl ganoderate J

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
CHEMBL221 P23219 Cyclooxygenase-1 97.74% 90.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.87% 96.09%
CHEMBL2581 P07339 Cathepsin D 95.43% 98.95%
CHEMBL2996 Q05655 Protein kinase C delta 95.12% 97.79%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 93.05% 94.45%
CHEMBL299 P17252 Protein kinase C alpha 91.56% 98.03%
CHEMBL3137262 O60341 LSD1/CoREST complex 91.54% 97.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 89.51% 97.25%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.46% 95.56%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 87.45% 85.30%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 85.50% 99.23%
CHEMBL1914 P06276 Butyrylcholinesterase 83.36% 95.00%
CHEMBL1994 P08235 Mineralocorticoid receptor 82.59% 100.00%
CHEMBL3430907 Q96GD4 Aurora kinase B/Inner centromere protein 82.01% 97.50%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.58% 86.33%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 81.48% 90.71%
CHEMBL340 P08684 Cytochrome P450 3A4 81.10% 91.19%
CHEMBL1937 Q92769 Histone deacetylase 2 81.07% 94.75%
CHEMBL240 Q12809 HERG 81.00% 89.76%
CHEMBL5028 O14672 ADAM10 80.19% 97.50%

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 101491700
LOTUS LTS0137288
wikiData Q77280585