2,10,10-Trimethyl-7-methylidenetricyclo[6.3.0.01,5]undecane

Details

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Internal ID 377b3ea5-b462-406d-aba2-60b3565950ec
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Triquinane sesquiterpenoids > Angular triquinanes
IUPAC Name 2,10,10-trimethyl-7-methylidenetricyclo[6.3.0.01,5]undecane
SMILES (Canonical) CC1CCC2C13CC(CC3C(=C)C2)(C)C
SMILES (Isomeric) CC1CCC2C13CC(CC3C(=C)C2)(C)C
InChI InChI=1S/C15H24/c1-10-7-12-6-5-11(2)15(12)9-14(3,4)8-13(10)15/h11-13H,1,5-9H2,2-4H3
InChI Key CPNKKZQGNNFQGD-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H24
Molecular Weight 204.35 g/mol
Exact Mass 204.187800766 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 4.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2,10,10-Trimethyl-7-methylidenetricyclo[6.3.0.01,5]undecane

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 92.83% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.58% 96.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 90.83% 97.25%
CHEMBL3137262 O60341 LSD1/CoREST complex 89.28% 97.09%
CHEMBL4803 P29474 Nitric-oxide synthase, endothelial 84.65% 86.00%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.05% 95.89%
CHEMBL2553 Q15418 Ribosomal protein S6 kinase alpha 1 83.05% 85.11%
CHEMBL1994 P08235 Mineralocorticoid receptor 81.81% 100.00%
CHEMBL5600 P27448 Serine/threonine-protein kinase c-TAK1 81.06% 88.81%

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.
Lophozia ventricosa

Cross-Links

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PubChem 73806537
LOTUS LTS0134868
wikiData Q104967660