1,5-Dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene

Details

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Internal ID ca1f2641-3c55-4f8e-8671-a6a845dd6e72
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Germacrane sesquiterpenoids
IUPAC Name 1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene
SMILES (Canonical) CC1=CCCC(=CCC(=C(C)C)CC1)C
SMILES (Isomeric) CC1=CCCC(=CCC(=C(C)C)CC1)C
InChI InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3
InChI Key GXEGJTGWYVZSNR-UHFFFAOYSA-N
Popularity 1 reference 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 4.10

Synonyms

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FT-0778143
1,5-dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene

2D Structure

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2D Structure of 1,5-Dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene

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 90.28% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 87.24% 96.09%
CHEMBL4208 P20618 Proteasome component C5 84.41% 90.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.23% 95.56%
CHEMBL2581 P07339 Cathepsin D 80.82% 98.95%

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.
Asarum caulescens
Cedrela odorata
Eugenia uniflora
Humulus lupulus
Porophyllum angustissimum
Valeriana officinalis
Vepris unifoliolata

Cross-Links

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PubChem 177602
LOTUS LTS0204193
wikiData Q104167559