• Định danh

    Số CAS
    471-15-8

    Công thức phân tử
    C10H16O

    SMILES
    C[C@H]1[C@H]2C[C@]2(CC1=O)C(C)C

    Chỉ số lưu (RI)

    • DB5: 1118.0
    • Carbowax: 1442.43
  • Thuộc tính

    XLogP3-AA
    2.3 Tan tốt trong DEP, BB, MMB

    Khối lượng phân tử
    152.23 g/mol

  • Các tên gọi

    • beta-Thujone
    • (+)-Isothujone
    • (+)-Thujone
    • (+)-3-Thujone
    • 471-15-8
    • Isothujone
    • d-Isothujone
    • (+)-beta-Thujone
    • D-beta-Thujone
    • THUJONE
    • .beta.-Thujone
    • (1S,4S,5R)-(+)-3-thujanone
    • trans-thujone
    • cis-Thujone
    • 8ZI5R3T54Q
    • NSC 67392
    • 3-Thujanone, (1S,4S,5R)-(+)-
    • .BETA.-THUJONE [MI]
    • (1S,4S,5R)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
    • CHEBI:50045
    • (1s,4s,5r)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one
    • NSC-67392
    • [1S-(1alpha,4beta,5alpha)]-4-methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-one
    • 3-isothujone
    • (1S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one (1S,4S,5R)-thujan-3-one
    • BICYCLO(3.1.0)HEXAN-3-ONE, 4-METHYL-1-(1-METHYLETHYL)-, (1S,4S,5R)
    • (+)-thujan-3-one
    • DTXSID20859476
    • UNII-8ZI5R3T54Q
    • NSC67392
    • beta Thujone
    • AI3-11501
    • EINECS 214-405-7
    • rel-(1R,4R,5S)-1-isopropyl-4-methylbicyclo(3.1.0)hexan-3-one
    • rel-(1R,4R,5S)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
    • rel-(1R,4R,5S)-4-methyl-1-(propan-2-yl)bicyclo(3.1.0)hexan-3-one
    • rel-(1R,4R,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
    • D-beta
    • NSC 407281
    • thujone (trans-)
    • (+)-cis-Thujone
    • (+)-b-Thujone
    • 3-Thujanone (8CI)
    • beta-thujone, 1S-(1alpha,4beta,5alpha)-isomer
    • SCHEMBL337540
    • beta-thujone, (1S-(1alpha,4alpha,5alpha))-isomer
    • (1S,4S,5R)-thujan-3-one
    • CHEMBL3277898
    • DTXSID7057575
    • CHEBI:50044
    • DTXCID90209404
    • USMNOWBWPHYOEA-XKSSXDPKSA-N
    • rel-(1R,4R,5S)-thujan-3-one
    • (1S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
    • (+)-Isothujone ((+)-beta-Thujone)
    • AKOS006240449
    • LMPR0102120039
    • Bicyclo(3.1.0)hexan-3-one, 4-methyl-1-(1-methylethyl)-, (1S-(1-alpha,4-beta,5-alpha))-
    • NS00076400
    • C20260
    • Q27121861
1 trong số 3
Tên CAS Thực vật Tỷ lệ
Achillea abrotanoides Achillea abrotanoides (Vis.) Vis., fam. Asteraceae (Compositae) 10.2%
Achillea wilhelmsii (Egypt) Achillea wilhelmsii C. Koch (A. santolina Auct. Mult.), fam. Asteraceae 0.3%
Lanyana (Oregon-USA) Artemisia afra Jacq., fam. Asteraceae (Compositae) 13.7%
Artemisia nilagirica (vulgaris) (India) 2 Artemisia nilagirica (C.B. Clarks) Pamp. (A. vulgaris Hook f.), Asteraceae 7.49%
Artemisia vestita (India) Artemisia vestita Wall. ex Dc., fam. Asteraceae (Compositae) 0.69%
Artemisia nilagirica (vulgaris) (India) 1 Artemisia nilagirica (C.B. Clarks) Pamp. (A. vulgaris Hook f.), Asteraceae 0.23%
Balsamite/Costmary Chrysanthemum balsamita L., fam. Asteraceae (Compositae) 0.19%
Cedarleaf 3 8000-27-9 Thuja occidentalis L., fam. Taxodiaceae 7.85%
Cedarleaf 2 8000-27-9 Thuja occidentalis L., fam. Taxodiaceae 11.85%
Eucalyptus globulus (Hungary) fruit 8016-26-0 Eucalyptus globulus Labill., fam. Myrtaceae 0.56%
Galangal root (Indonesia) 8023-91-4 Alpinia galanga (L.) Willd., fam. Zingiberaceae 0.01%
Spike lavender (Spain) 3 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.01%
Hyssop (France) 1 8006-83-5 Hyssopus officinalis L., fam. Lamiaceae (Labiatae) 0.05%
Hyssop (USA) 8006-83-5 Hyssopus officinalis L., fam. Lamiaceae (Labiatae) 0.33%
Hyssop (Himalaya) 8006-83-5 Hyssopus officinalis L., fam. Lamiaceae (Labiatae) 0.1%
Juniperus foetidissima leaf Juniperus foetidissima Willd., fam. Cupressaceae 3.5%
Dracocephalum kotschyi Dracocephalum kotschyi Boiss., fam. Lamiaceae (Labiatae) 0.5%
Lanyana (South Africa) 1 Artemisia afra Jacq., fam. Asteraceae (Compositae) 13.1%
Nigella sativa seed Nigella sativa L., fam. Ranunculaceae 0.01%
Olibanum, Indian (India) 8016-36-2 Boswellia serrata Roxb. ex Colebr., fam. Burseraceae 1.4%
Sage, dalmatian (Hungary) 1 8022-56-8 Salvia officinalis L., fam. Lamiaceae (Labiatae) 6.6%
Sage, dalmatian (Italy) 3 8022-56-8 Salvia officinalis L., fam. Lamiaceae (Labiatae) 4.3%
Savin 1 8024-00-8 Juniperus sabina L., fam. Cupressaceae 0.6%
Tansy (Belgium) 8016-87-3 Tanacetum vulgare L., fam. Asteraceae (Compositae) 50.0%
Tarragon (Italy) 1 8016-88-4 Artemisia dracunculus L. (French type), fam. Asteraceae (Compositae) 0.09%
Wormwood (Mugwort) 1 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 2.7%
Wormwood (Mugwort), headspace 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 2.0%
Wormwood Roman, headspace Artemisia pontica L., fam. Asteraceae (Compositae) 1.8%
Wormwood Roman Artemisia pontica L., fam. Asteraceae (Compositae) 3.3%
Melittis melissophyllum Melittis melissophylum L., ssp. albida Guss, fam. Lamiaceae (Labiatae) 0.38%
Sage, dalmatian var. Albiflora (USA) 8022-56-8 Salvia officinalis L. var. Albiflora, fam. Lamiaceae (Labiatae) 36.77%
Sage, dalmatian var. Berggarten (USA) 8022-56-8 Salvia officinalis L. var. Berggarten, fam. Lamiaceae (Labiatae) 2.34%
Sage, dalmatian var. Compacta (USA) 8022-56-8 Salvia officinalis L. var. Compacta, fam. Lamiaceae (Labiatae) 1.02%
Sage, dalmatian var. Icterina (USA) 8022-56-8 Salvia officinalis L. var. Icterina, fam. Lamiaceae (Labiatae) 2.17%
Sage, dalmatian var. Purpurascens (USA) 8022-56-8 Salvia officinalis L. var. Purpurascens, fam Lamiaceae (Labiatae) 2.38%
Sage, dalmatian var. Rubriflora (USA) 8022-56-8 Salvia officinalis L. var. Rubriflora, fam. Lamiaceae (Labiatae) 6.21%
Sage, dalmatian var. Tricolor (USA) 8022-56-8 Salvia officinalis L. var. Tricolor, fam. Lamiaceae (Labiatae) 2.59%
Sage, dalmatian var. Woodcote Farm (USA) 8022-56-8 Salvia officinalis L. var. Woodcote Farm, fam. Lamiaceae (Labiatae) 2.6%
Thyme (Italy) 1 8007-46-3 Thymus vulgaris L., fam. Lamiaceae (Labiatae) 0.07%
Yarrow (Canada) 1 84082-83-7 Achillea millefolium L., fam. Asteraceae (Compositae) 13.5%
Ginger (Japan) 2 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.01%
Savin (var. Acadia) 8024-00-8 Juniperus sabina L. var. Acadia, fam. Cupressaceae 0.2%
Savin (var. Blue Danube) 8024-00-8 Juniperus sabina L. var. Blue Danube, fam. Cupressaceae 0.9%
Savin (var. J.S. Mascula) 8024-00-8 Juniperus sabina L. var. J.S. Mascula, fam. Cupressaceae 1.5%
Savin 3 8024-00-8 Juniperus sabina L., fam. Cupressaceae 1.0%
Savin 4 8024-00-8 Juniperus sabina L., fam. Cupressaceae 1.1%
Artemisia persica (India) Artemisia persica Boiss., fam. Asteraceae (Compositae) 1.1%
Tagetes 2 8016-84-0 Tagetes minuta L. (Marigold), fam. Asteraceae (Compositae) 0.5%
Wormwood (Mugwort) (Germany) 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 46.44%
Wormwood (Mugwort) (U.S.A.) 1 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 35.0%