[5,9-Dimethyl-12-(6-methylhepta-1,5-dien-2-yl)cyclotetradeca-4,8-dien-1-yl]methanol

Details

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Internal ID 09112875-ad77-4c10-b76f-5d9a189af99b
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesterterpenoids
IUPAC Name [5,9-dimethyl-12-(6-methylhepta-1,5-dien-2-yl)cyclotetradeca-4,8-dien-1-yl]methanol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C25H42O/c1-20(2)9-6-13-23(5)25-17-15-22(4)11-7-10-21(3)12-8-14-24(19-26)16-18-25/h9,11-12,24-26H,5-8,10,13-19H2,1-4H3
InChI Key DVHRFHOKROCIPF-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C25H42O
Molecular Weight 358.60 g/mol
Exact Mass 358.323565959 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 7.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of [5,9-Dimethyl-12-(6-methylhepta-1,5-dien-2-yl)cyclotetradeca-4,8-dien-1-yl]methanol

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 97.21% 91.11%
CHEMBL2581 P07339 Cathepsin D 89.68% 98.95%
CHEMBL1994 P08235 Mineralocorticoid receptor 88.12% 100.00%
CHEMBL253 P34972 Cannabinoid CB2 receptor 87.81% 97.25%
CHEMBL3137262 O60341 LSD1/CoREST complex 87.60% 97.09%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.68% 96.09%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 86.09% 95.89%
CHEMBL5608 Q16288 NT-3 growth factor receptor 83.30% 95.89%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 81.60% 95.56%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 162989807
LOTUS LTS0095996
wikiData Q104990141