2,6,10,14,19,23-Hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol

Details

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Internal ID 87320f8f-30ac-4178-bc98-7d87af8fe6ce
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Triterpenoids
IUPAC Name 2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol
SMILES (Canonical) CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)C)C
SMILES (Isomeric) CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)C)C
InChI InChI=1S/C30H42O/c1-25(2)15-11-18-26(3)16-9-10-17-27(4)19-12-20-28(5)21-13-22-29(6)23-14-24-30(7,8)31/h9-23,31H,24H2,1-8H3
InChI Key FOIFOTKOVLXQJE-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C30H42O
Molecular Weight 418.70 g/mol
Exact Mass 418.323565959 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 10.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2,6,10,14,19,23-Hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol

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
CHEMBL4040 P28482 MAP kinase ERK2 91.33% 83.82%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 88.65% 89.34%
CHEMBL2061 P19793 Retinoid X receptor alpha 84.54% 91.67%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 84.30% 96.09%
CHEMBL1977 P11473 Vitamin D receptor 83.26% 99.43%
CHEMBL2004 P48443 Retinoid X receptor gamma 82.79% 100.00%
CHEMBL253 P34972 Cannabinoid CB2 receptor 82.66% 97.25%
CHEMBL1870 P28702 Retinoid X receptor beta 82.48% 95.00%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 82.38% 96.95%
CHEMBL3401 O75469 Pregnane X receptor 82.05% 94.73%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.60% 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 75219760
LOTUS LTS0191768
wikiData Q104166624