(3Z)-9-Methyl-3-undecene

Details

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Internal ID cd0c3c06-2d5c-449f-bf93-949e5c5b22d3
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Unsaturated aliphatic hydrocarbons
IUPAC Name 9-methylundec-3-ene
SMILES (Canonical) CCC=CCCCCC(C)CC
SMILES (Isomeric) CCC=CCCCCC(C)CC
InChI InChI=1S/C12H24/c1-4-6-7-8-9-10-11-12(3)5-2/h6-7,12H,4-5,8-11H2,1-3H3
InChI Key RTETXCZSLJTHLA-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C12H24
Molecular Weight 168.32 g/mol
Exact Mass 168.187800766 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 5.50

Synonyms

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74630-50-5
DTXSID50338683

2D Structure

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2D Structure of (3Z)-9-Methyl-3-undecene

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 91.57% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 88.63% 99.17%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 85.45% 96.47%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.37% 96.09%
CHEMBL239 Q07869 Peroxisome proliferator-activated receptor alpha 84.44% 90.75%
CHEMBL2885 P07451 Carbonic anhydrase III 83.81% 87.45%
CHEMBL3359 P21462 Formyl peptide receptor 1 83.73% 93.56%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 83.68% 97.29%
CHEMBL4588 P22894 Matrix metalloproteinase 8 81.95% 94.66%
CHEMBL1907 P15144 Aminopeptidase N 81.37% 93.31%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 81.21% 89.34%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 80.84% 96.00%
CHEMBL221 P23219 Cyclooxygenase-1 80.01% 90.17%

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.
Glycyrrhiza glabra

Cross-Links

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PubChem 550666
LOTUS LTS0140564
wikiData Q82107270