Details of Natural Product (NP)

General Information of Natural Product (ID: NP0797)
Natural Product Name	6-Methyl-5-Methylideneheptan-2-One
Synonyms	Thujaketone; 6-Methyl-5-methylene-2-heptanone; 6-Methyl-5-methylideneheptan-2-one; 2-Heptanone, 6-methyl-5-methylene-; 5-Isopropyl-5-hexen-2-one #; SCHEMBL13255954; 5-methylene-6-methylheptan-2-one; 498-51-1 Click to Show/Hide
Formula	C₉H₁₆O
Weight	140.22
Structure
Structure	3D Structure Download		2D Structure Download
InChI	InChI=1S/C9H16O/c1-7(2)8(3)5-6-9(4)10/h7H,3,5-6H2,1-2,4H3
InChI Key	RNUYQXXGCJJIPA-UHFFFAOYSA-N
Isomeric SMILES	CC(C)C(=C)CCC(=O)C
Canonical SMILES	CC(C)C(=C)CCC(=O)C
External Links	PubChem ID	536980
External Links	CAS ID	498-51-1

The Content Variation of Natural Product Induced by Different Factor(s)
Species Name: Artemisia verlotiorum
	Factor Name: Developmental Stage Variation				[1]
Species Info Factor Info
Experiment Detail		Plant material of A. verlotiorum was harvested near Marseille (France) in May (before blooming) and November (full flowering) 2000. Click to Show/Hide
Factor Function		For the oil from the vegetative plants, 50 compounds, representing 99.8% of the oil were characterized. Fifty-nine compounds, representing 99.6% of the oil were identified in the oil from flowering plants. In both cases, the constituents were mainly oxygenated monoterpenes (74% and 88%). The composition of each oil showed only a few differences, as the main components were alpha-thujone (55% and 44%), 1,8-cineole (5% and 15%), beta-caryophyllene (13% and 7%) and beta-thujone (5% and 11%), in the oils of the vegetative plant and flowering plant, respectively. The proportions of the oxygenated compounds seemed to increase during flowering. Click to Show/Hide
Factor			Part	Location		NP Content
Aerial part: full flowering stage			Aerial parts	Marseille, France		NP Content: 0.1 %

References
1	Chemical Variation in the Oil of Artemisia verlotiorum Lamotte of French Origin Harvested at a Vegetative Stage and During Flowering