Cyclipostin D

Details

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Internal ID dc1645d5-980b-46dc-8b4b-4d8b0236ef66
Taxonomy Organoheterocyclic compounds > Lactones > Gamma butyrolactones
IUPAC Name (3R,8aR)-3-(15-hydroxyhexadecoxy)-5-methyl-3-oxo-8,8a-dihydro-1H-furo[3,4-e][1,3,2]dioxaphosphepin-6-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C23H41O7P/c1-19(24)15-13-11-9-7-5-3-4-6-8-10-12-14-16-28-31(26)29-18-21-17-27-23(25)22(21)20(2)30-31/h19,21,24H,3-18H2,1-2H3/t19?,21-,31-/m1/s1
InChI Key CYWMPQGLAWZTPM-UCCBIPKYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C23H41O7P
Molecular Weight 460.50 g/mol
Exact Mass 460.25899064 g/mol
Topological Polar Surface Area (TPSA) 91.30 Ų
XlogP 5.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Cyclipostin D

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 97.69% 98.95%
CHEMBL253 P34972 Cannabinoid CB2 receptor 92.79% 97.25%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 91.03% 96.09%
CHEMBL5103 Q969S8 Histone deacetylase 10 90.25% 90.08%
CHEMBL3060 Q9Y345 Glycine transporter 2 89.26% 99.17%
CHEMBL3401 O75469 Pregnane X receptor 88.55% 94.73%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 88.24% 96.47%
CHEMBL3359 P21462 Formyl peptide receptor 1 87.30% 93.56%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 85.91% 95.56%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.02% 97.09%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 83.55% 99.23%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 83.15% 91.11%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 82.72% 93.03%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 82.02% 97.21%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 81.92% 85.94%
CHEMBL1075162 Q13304 Uracil nucleotide/cysteinyl leukotriene receptor 80.99% 80.33%

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 11037880
LOTUS LTS0240692
wikiData Q77370508