2-Pinen-5-ol

Details

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Internal ID 1b9792e6-92a8-457c-a5a1-73e62f734c45
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Bicyclic monoterpenoids
IUPAC Name 4,6,6-trimethylbicyclo[3.1.1]hept-3-en-1-ol
SMILES (Canonical) CC1=CCC2(CC1C2(C)C)O
SMILES (Isomeric) CC1=CCC2(CC1C2(C)C)O
InChI InChI=1S/C10H16O/c1-7-4-5-10(11)6-8(7)9(10,2)3/h4,8,11H,5-6H2,1-3H3
InChI Key LKGUYHHEOJFHPV-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C10H16O
Molecular Weight 152.23 g/mol
Exact Mass 152.120115130 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 1.60

Synonyms

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LKGUYHHEOJFHPV-UHFFFAOYSA-N

2D Structure

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2D Structure of 2-Pinen-5-ol

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 91.67% 91.11%
CHEMBL253 P34972 Cannabinoid CB2 receptor 91.22% 97.25%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 91.14% 96.09%
CHEMBL3137262 O60341 LSD1/CoREST complex 85.66% 97.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 82.38% 95.56%
CHEMBL4208 P20618 Proteasome component C5 81.55% 90.00%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.24% 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.
Zingiber officinale

Cross-Links

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PubChem 6428927
LOTUS LTS0155332
wikiData Q105153057