2,10,10-Trimethyl-6-methylidenetricyclo[7.1.1.01,5]undecane

Details

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Internal ID 0f3df66d-931a-4c77-947c-c704107ce0ef
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Iridoids and derivatives
IUPAC Name 2,10,10-trimethyl-6-methylidenetricyclo[7.1.1.01,5]undecane
SMILES (Canonical) CC1CCC2C13CC(C3(C)C)CCC2=C
SMILES (Isomeric) CC1CCC2C13CC(C3(C)C)CCC2=C
InChI InChI=1S/C15H24/c1-10-5-7-12-9-15(14(12,3)4)11(2)6-8-13(10)15/h11-13H,1,5-9H2,2-4H3
InChI Key HOMAFFTYQJEIDP-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-6-methylidenetricyclo[7.1.1.01,5]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
CHEMBL1951 P21397 Monoamine oxidase A 92.69% 91.49%
CHEMBL253 P34972 Cannabinoid CB2 receptor 86.42% 97.25%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.67% 96.09%
CHEMBL2039 P27338 Monoamine oxidase B 83.38% 92.51%
CHEMBL3137262 O60341 LSD1/CoREST complex 82.85% 97.09%
CHEMBL1994 P08235 Mineralocorticoid receptor 81.75% 100.00%

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.
Chrysopogon zizanioides

Cross-Links

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PubChem 91753599
LOTUS LTS0149543
wikiData Q105031374