malonganenon G

Details

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Internal ID 4d4b5529-7721-4ca5-98bd-1d0c7d507a45
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Diterpenoids
IUPAC Name 5-[formyl(methyl)amino]-N-methyl-3-[(2E,6E,11E)-3,7,11,15-tetramethyl-13-oxohexadeca-2,6,11-trienyl]imidazole-4-carboxamide
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C27H42N4O3/c1-20(2)16-24(33)17-23(5)13-9-11-21(3)10-8-12-22(4)14-15-31-18-29-26(30(7)19-32)25(31)27(34)28-6/h10,14,17-20H,8-9,11-13,15-16H2,1-7H3,(H,28,34)/b21-10+,22-14+,23-17+
InChI Key BRGBNADJYSOXIE-GWKLWHMYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C27H42N4O3
Molecular Weight 470.60 g/mol
Exact Mass 470.32569121 g/mol
Topological Polar Surface Area (TPSA) 84.30 Ų
XlogP 5.60

Synonyms

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CHEMBL229705

2D Structure

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2D Structure of malonganenon G

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 98.80% 96.09%
CHEMBL3401 O75469 Pregnane X receptor 94.97% 94.73%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 92.87% 89.34%
CHEMBL3060 Q9Y345 Glycine transporter 2 92.56% 99.17%
CHEMBL2581 P07339 Cathepsin D 92.34% 98.95%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 90.69% 94.45%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 90.10% 93.10%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 88.38% 90.71%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 87.60% 96.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.42% 95.56%
CHEMBL5163 Q9NY46 Sodium channel protein type III alpha subunit 84.15% 96.90%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 83.82% 100.00%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 83.30% 94.33%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 81.35% 91.11%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 16756431
LOTUS LTS0083050
wikiData Q104944783