Altematamide A

Details

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Internal ID ceda2d28-f790-4281-957d-de98e2ee766b
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Leucine and derivatives
IUPAC Name (2S)-4-methyl-2-(methylamino)-N-[2-(2,5,6-tribromo-1-methylindol-3-yl)ethyl]pentanamide
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H24Br3N3O/c1-10(2)7-15(22-3)18(25)23-6-5-11-12-8-13(19)14(20)9-16(12)24(4)17(11)21/h8-10,15,22H,5-7H2,1-4H3,(H,23,25)/t15-/m0/s1
InChI Key KHRZQNJMQDSRQY-HNNXBMFYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C18H24Br3N3O
Molecular Weight 538.10 g/mol
Exact Mass 536.94490 g/mol
Topological Polar Surface Area (TPSA) 46.10 Ų
XlogP 5.30

Synonyms

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CHEMBL518674

2D Structure

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2D Structure of Altematamide A

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 99.30% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.78% 96.09%
CHEMBL4835 P00338 L-lactate dehydrogenase A chain 95.02% 95.34%
CHEMBL1293255 P15428 15-hydroxyprostaglandin dehydrogenase [NAD+] 90.48% 83.57%
CHEMBL4208 P20618 Proteasome component C5 89.96% 90.00%
CHEMBL202 P00374 Dihydrofolate reductase 89.06% 89.92%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.48% 95.56%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 87.72% 90.71%
CHEMBL255 P29275 Adenosine A2b receptor 87.54% 98.59%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 86.69% 96.00%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 86.37% 89.62%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 85.22% 100.00%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 84.66% 91.11%
CHEMBL3359 P21462 Formyl peptide receptor 1 83.71% 93.56%
CHEMBL335 P18031 Protein-tyrosine phosphatase 1B 82.91% 95.17%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.82% 99.17%
CHEMBL1806 P11388 DNA topoisomerase II alpha 81.77% 89.00%
CHEMBL3837 P07711 Cathepsin L 81.50% 96.61%
CHEMBL4073 P09237 Matrix metalloproteinase 7 81.43% 97.56%
CHEMBL3155 P34969 Serotonin 7 (5-HT7) receptor 80.97% 90.71%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.78% 86.33%
CHEMBL3401 O75469 Pregnane X receptor 80.17% 94.73%

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 10075903
LOTUS LTS0230193
wikiData Q105141307