Thujaplicin information

Thujaplicin
	; α-Thujaplicin
	; β-Thujaplicin (hinokitiol)
	; γ-Thujaplicin
Identifiers
CAS Number	α: 1946-74-3 ; β: 499-44-5 ; γ: 672-76-4 ;
3D model (JSmol)	α: Interactive image; β: Interactive image; γ: Interactive image;
ChEBI	β: CHEBI:10447; γ: CHEBI:10578;
ChEMBL	α: ChEMBL1275969; β: ChEMBL48310;
EC Number	β: 207-880-7;
PubChem CID	α: 80297; β: 3611; γ: 12649;
UNII	β: U5335D6EBI; γ: CA2K6LJ2BV;
CompTox Dashboard (EPA)	α: DTXSID70173098; β: DTXSID6043911; γ: DTXSID2060969;
	InChI α: InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(11)10(8)12/h3-7H,1-2H3,(H,11,12) Key: TUFYVOCKVJOUIR-UHFFFAOYSA-N; β: InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12) Key: FUWUEFKEXZQKKA-UHFFFAOYSA-N; γ: InChI=1S/C10H12O2/c1-7(2)8-3-5-9(11)10(12)6-4-8/h3-7H,1-2H3,(H,11,12) Key: WKEWHSLZDDZONF-UHFFFAOYSA-N;
	SMILES α: CC(C)C1=C(C(=O)C=CC=C1)O; β: CC(C)C1=CC(=O)C(=CC=C1)O; γ: CC(C)C1=CC=C(C(=O)C=C1)O;
Properties
Chemical formula	C10H12O2
Molar mass	164.204 g·mol−1
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Thujaplicin (isopropyl cycloheptatrienolone) is any of three isomeric tropolone-related natural products that have been isolated from the softwoods of the trees of Cupressaceae family.^[1] These compounds are known for their antibacterial, antifungal, and antioxidant properties.^[2]^[3] They were the first natural tropolones to be made synthetically.^[4]

^ ERDTMAN, HOLGER; GRIPENBERG, JARL (May 1948). "Antibiotic Substances from the Heart Wood of Thuja plicata Don". Nature. 161 (4097): 719. Bibcode:1948Natur.161..719E. doi:10.1038/161719a0. PMID 18860272. S2CID 4074514.
^ Chedgy, Russell J.; Lim, Young Woon; Breuil, Colette (May 2009). "Effects of leaching on fungal growth and decay of western redcedar". Canadian Journal of Microbiology. 55 (5): 578–586. doi:10.1139/W08-161. PMID 19483786.
^ Chedgy, R. (2010). Secondary Metabolites of Western Red Cedar (Thuja plicata). Lambert Academic Publishing. ISBN 978-3-8383-4661-8.
^ Cook, J. W.; Raphael, R. A.; Scott, A. I. (1951). "149. Tropolones. Part II. The synthesis of α-, β-, and γ-thujaplicins". J. Chem. Soc.: 695–698. doi:10.1039/JR9510000695.

[1] ERDTMAN, HOLGER; GRIPENBERG, JARL (May 1948). "Antibiotic Substances from the Heart Wood of Thuja plicata Don". Nature. 161 (4097): 719. Bibcode:1948Natur.161..719E. doi:10.1038/161719a0. PMID 18860272. S2CID 4074514.

[2] Chedgy, Russell J.; Lim, Young Woon; Breuil, Colette (May 2009). "Effects of leaching on fungal growth and decay of western redcedar". Canadian Journal of Microbiology. 55 (5): 578–586. doi:10.1139/W08-161. PMID 19483786.

[3] Chedgy, R. (2010). Secondary Metabolites of Western Red Cedar (Thuja plicata). Lambert Academic Publishing. ISBN 978-3-8383-4661-8.

[Tropolones-4] Cook, J. W.; Raphael, R. A.; Scott, A. I. (1951). "149. Tropolones. Part II. The synthesis of α-, β-, and γ-thujaplicins". J. Chem. Soc.: 695–698. doi:10.1039/JR9510000695.

Thujaplicin information

and 27 Related for: Thujaplicin information

Thujaplicin

Hinokitiol

C10H12O2

Limonene

Thujaplicinol

Cedar oil

Thuja plicata

Steroid

Chamaecyparis obtusa

Wood

Dietary fiber

Natural rubber

Cholecalciferol

Terpene

Terpenoid

Tropolone

Squalene

Menthol

Phytochemical

Capsaicin

Thymol

Polyphenol

Monoterpene

Betalain

Triterpene

Lycopene

Saponin

Identifiers
α-Thujaplicin
β-Thujaplicin (hinokitiol)
γ-Thujaplicin
CAS Number	α: 1946-74-3^N β: 499-44-5^N γ: 672-76-4^N
3D model (JSmol)	α: Interactive image β: Interactive image γ: Interactive image
ChEBI	β: CHEBI:10447 γ: CHEBI:10578
ChEMBL	α: ChEMBL1275969 β: ChEMBL48310
EC Number	β: 207-880-7
PubChem CID	α: 80297 β: 3611 γ: 12649
UNII	β: U5335D6EBI γ: CA2K6LJ2BV
CompTox Dashboard (EPA)	α: DTXSID70173098 β: DTXSID6043911 γ: DTXSID2060969
InChI α: InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(11)10(8)12/h3-7H,1-2H3,(H,11,12) Key: TUFYVOCKVJOUIR-UHFFFAOYSA-N β: InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12) Key: FUWUEFKEXZQKKA-UHFFFAOYSA-N γ: InChI=1S/C10H12O2/c1-7(2)8-3-5-9(11)10(12)6-4-8/h3-7H,1-2H3,(H,11,12) Key: WKEWHSLZDDZONF-UHFFFAOYSA-N
SMILES α: CC(C)C1=C(C(=O)C=CC=C1)O β: CC(C)C1=CC(=O)C(=CC=C1)O γ: CC(C)C1=CC=C(C(=O)C=C1)O
Properties
Chemical formula	C₁₀H₁₂O₂
Molar mass	164.204 g·mol⁻¹
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references