Platydiol

Details

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Internal ID b9b48d0c-0cd6-4258-b140-3e87554c1f93
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Bicyclic monoterpenoids
IUPAC Name (2R,6S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,6-diol
SMILES (Canonical) CC1(C2CC(C1(C(C2)O)C)O)C
SMILES (Isomeric) CC1(C2C[C@H](C1([C@H](C2)O)C)O)C
InChI InChI=1S/C10H18O2/c1-9(2)6-4-7(11)10(9,3)8(12)5-6/h6-8,11-12H,4-5H2,1-3H3/t6?,7-,8+,10?
InChI Key UAENXMZBFMXPED-VZCHMASFSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C10H18O2
Molecular Weight 170.25 g/mol
Exact Mass 170.130679813 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 1.40

Synonyms

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DTXSID801318591
70630-07-8

2D Structure

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2D Structure of Platydiol

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.00% 96.09%
CHEMBL206 P03372 Estrogen receptor alpha 91.28% 97.64%
CHEMBL253 P34972 Cannabinoid CB2 receptor 88.12% 97.25%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.81% 97.09%
CHEMBL221 P23219 Cyclooxygenase-1 83.56% 90.17%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 82.21% 91.11%
CHEMBL2996 Q05655 Protein kinase C delta 80.79% 97.79%

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.
Platycladus orientalis

Cross-Links

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PubChem 14431885
LOTUS LTS0132985
wikiData Q104397392