Phyto4Health

Terpinolene

Representations & DB's id

ChEBI: CHEBI:9457
ChEMBL: CHEMBL454697
PubChem: 11463
IUPAC: 1-methyl-4-propan-2-ylidenecyclohexene
Standard InChI: InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4H,5-7H2,1-3H3
Standard InChI Key: MOYAFQVGZZPNRA-UHFFFAOYSA-N
SMILES: CC1=CCC(=C(C)C)CC1

Molecular propeties

AlogP: 3.45
Hydrogen bonds acceptors: 0
Hydrogen bonds donors: 0
Rotatable bonds: 0
Number of rings: 1
Molecular Weight: 136.13
Topological polar surface area: 0
Number of aromatic rings: 0
Fsp3: 0.6
Number of carbons: 10

Plant sources

Part of plant Plant name Ref.
HerbaHypericum perforatum
Essential OilPrunus armeniaca
Essential OilPrunus armeniaca
PlantPrunus laurocerasus
FructusSchisandra chinensis
PericarpiumCitrus unshiu
Essential OilPrunus armeniaca
PlantAnacyclus pyrethrum
FruitRibes nigrum
BudRibes nigrum
Resin, Exudate, SapPinus sylvestris
Leaf Essent. OilPinus sylvestris
FlowerPinus sylvestris
Essential OilPinus sylvestris
PlantThymus vulgaris
SeedCarum carvi
FruitCarum carvi
Leaf Essent. OilValeriana officinalis
Root Essent. OilValeriana officinalis
RootValeriana officinalis
LeafValeriana officinalis
Leaf Essent. OilValeriana officinalis
Root Essent. OilValeriana officinalis
RootValeriana officinalis
LeafValeriana officinalis
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
Leaf Essent. OilValeriana officinalis
Root Essent. OilValeriana officinalis
RootValeriana officinalis
LeafValeriana officinalis
FructusFoeniculum vulgare
FructusFoeniculum vulgare
FructusFoeniculum vulgare
Essential OilPrunus armeniaca
StrobilusHumulus lupulus
Leaf Essent. OilSalvia officinalis
PlantSalvia officinalis
PlantVitis vinifera

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.