Limonene

GPTKB entity

Statements (55)
Predicate Object
gptkbp:instanceOf terpene
gptkbp:appearance colorless liquid
gptkbp:aroma gptkb:orange
gptkbp:biosynthesized_from from geranyl pyrophosphate
gptkbp:boilingPoint 176 °C
gptkbp:CASNumber gptkb:138-86-3
gptkbp:category gptkb:butter
gptkb:entomologist
gptkb:food
gptkb:perfume
solvent
hydrocarbon
monoterpene
gptkbp:chemicalFormula C10H16
gptkbp:chirality chiral
gptkbp:density 0.8411 g/cm³
gptkbp:EC_number 205-341-0
gptkbp:enantiomers gptkb:D-limonene
gptkb:L-limonene
gptkbp:flammability flammable
gptkbp:foundIn citrus fruit peels
gptkbp:hasInChIKey gptkb:XMGQYMWWDOXHJM-UHFFFAOYSA-N
gptkbp:hasSMILES CC(=C)C1CCC(C)=CC1
https://www.w3.org/2000/01/rdf-schema#label Limonene
gptkbp:IUPACName gptkb:1-methyl-4-(1-methylethenyl)cyclohexene
gptkbp:KEGGID C06471
gptkbp:mainProducer grapefruit peels
lemon peels
lime peels
orange peels
gptkbp:meltingPoint -74 °C
gptkbp:metabolism oxidized to carveol and carvone
gptkbp:molecularWeight 136.24 g/mol
gptkbp:naturalProduct yes
gptkbp:PubChem_CID gptkb:CHEBI:15377
gptkb:CHEMBL108
440917
gptkbp:riskFactor H315 (causes skin irritation)
H317 (may cause allergic skin reaction)
H411 (toxic to aquatic life with long lasting effects)
gptkbp:solubility insoluble
soluble in ethanol
soluble in diethyl ether
gptkbp:structureType monocyclic monoterpene
gptkbp:toxicity low acute toxicity
gptkbp:UNII GFD7C86Q1W
gptkbp:uses gptkb:entomologist
gptkb:perfume
solvent
cleaning products
flavoring agent
gptkbp:bfsParent gptkb:Nutmeg
gptkb:Cardamom
gptkb:Oranges
gptkbp:bfsLayer 5