4-Methyltetracosane

Details

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Internal ID 437c06f6-1011-452e-9271-47c8df4af8c3
Taxonomy Hydrocarbons > Saturated hydrocarbons > Alkanes > Branched alkanes
IUPAC Name 4-methyltetracosane
SMILES (Canonical) CCCCCCCCCCCCCCCCCCCCC(C)CCC
SMILES (Isomeric) CCCCCCCCCCCCCCCCCCCCC(C)CCC
InChI InChI=1S/C25H52/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(3)23-5-2/h25H,4-24H2,1-3H3
InChI Key ZMWYRLCLGPLJAE-UHFFFAOYSA-N
Popularity 8 references in papers

Physical and Chemical Properties

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Molecular Formula C25H52
Molecular Weight 352.70 g/mol
Exact Mass 352.406901659 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 13.50

Synonyms

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Tetracosane, 4-methyl
76275-83-7
DTXSID70335811
ZMWYRLCLGPLJAE-UHFFFAOYSA-N

2D Structure

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2D Structure of 4-Methyltetracosane

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
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 95.32% 92.86%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 94.88% 97.29%
CHEMBL230 P35354 Cyclooxygenase-2 94.87% 89.63%
CHEMBL2581 P07339 Cathepsin D 93.85% 98.95%
CHEMBL2885 P07451 Carbonic anhydrase III 92.34% 87.45%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 91.74% 85.94%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 90.35% 92.08%
CHEMBL1907 P15144 Aminopeptidase N 90.21% 93.31%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 89.99% 91.81%
CHEMBL2996 Q05655 Protein kinase C delta 89.44% 97.79%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 88.78% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 88.66% 97.25%
CHEMBL4462 Q8IXJ6 NAD-dependent deacetylase sirtuin 2 87.35% 90.24%
CHEMBL3359 P21462 Formyl peptide receptor 1 86.47% 93.56%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.45% 99.17%
CHEMBL299 P17252 Protein kinase C alpha 84.73% 98.03%
CHEMBL4105838 Q96GG9 DCN1-like protein 1 84.53% 95.00%
CHEMBL221 P23219 Cyclooxygenase-1 82.05% 90.17%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 81.00% 100.00%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 80.05% 97.23%

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.
Hamamelis virginiana

Cross-Links

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PubChem 527470
LOTUS LTS0219723
wikiData Q82102450