Chrodrimanin L

Details

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Internal ID baaf758f-c1fc-4cb5-982b-4116a6a408cc
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Terpene lactones > Diterpene lactones
IUPAC Name (1S,6R,14R,15S,17R,20S,22S)-11,20-dichloro-10,15-dihydroxy-6,14,18,18,22-pentamethyl-7,13-dioxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-3,9,11-triene-8,19-dione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C25H30Cl2O6/c1-10-6-11-12-7-15-24(4)9-13(26)21(30)23(2,3)14(24)8-16(28)25(15,5)33-20(12)18(27)19(29)17(11)22(31)32-10/h10,13-16,28-29H,6-9H2,1-5H3/t10-,13+,14+,15+,16+,24+,25-/m1/s1
InChI Key AKANQXGAUVUBPO-JPAZTMTDSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C25H30Cl2O6
Molecular Weight 497.40 g/mol
Exact Mass 496.1419441 g/mol
Topological Polar Surface Area (TPSA) 93.10 Ų
XlogP 5.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Chrodrimanin L

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 99.41% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 97.20% 91.49%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.54% 95.56%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 91.35% 94.45%
CHEMBL3137262 O60341 LSD1/CoREST complex 90.87% 97.09%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 90.63% 89.34%
CHEMBL2581 P07339 Cathepsin D 88.90% 98.95%
CHEMBL253 P34972 Cannabinoid CB2 receptor 88.30% 97.25%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.04% 86.33%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 87.22% 96.95%
CHEMBL3713062 P10646 Tissue factor pathway inhibitor 86.51% 97.33%
CHEMBL1806 P11388 DNA topoisomerase II alpha 84.61% 89.00%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 83.28% 97.14%
CHEMBL5608 Q16288 NT-3 growth factor receptor 82.72% 95.89%
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 81.80% 96.77%

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 132967435
LOTUS LTS0194870
wikiData Q105095809