Sclareol

  • Định danh

    Số CAS
    515-03-7

    Công thức phân tử
    C20H36O2

    SMILES
    C[C@]12CCCC([C@@H]1CC[C@@]([C@@H]2CC[C@](C)(C=C)O)(C)O)(C)C

    Chỉ số lưu (RI)

    • DB5: 2218.5

  • Thuộc tính

    XLogP3-AA
    4.9 Tan tốt trong BB, IPM, DEP

    Khối lượng phân tử
    308.5 g/mol

    Độ tan

    • Practically insoluble or insoluble in water
    • Soluble (in ethanol)

  • Các tên gọi

    • Sclareol
    • 515-03-7
    • labd-14-ene-8,13-diol
    • (13R)-Labd-14-ene-8,13-diol
    • Sclareol (natural)
    • SCAREOL
    • (1R,2R,4aS,8aS)-1-((R)-3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
    • UNII-B607NP0Q8Y
    • B607NP0Q8Y
    • CHEBI:9053
    • DTXSID0047111
    • EINECS 208-194-0
    • (-)-SCLAREOL
    • BRN 2054148
    • Labd-14-ene-8,13-diol, (13R)-
    • DTXCID8027111
    • FEMA NO. 4502
    • 4-06-00-05554 (Beilstein Handbook Reference)
    • (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
    • (13R)-Labd-14-ene-8alpha,13-diol
    • Sclareol (~90%)
    • (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-en-1-yl]-2,5,5,8a-tetramethyl-decahydronaphthalen-2-ol
    • labd-14-ene-8alpha, 13beta-diol
    • (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
    • (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol labd-14-ene-8,13-diol
    • 1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, (1theta-(1alpha(theta),2beta,4abeta,8aalpha))-
    • 1-Naphthalenepropanol, decahydro-alpha-ethenyl-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, (1R-(1-alpha(R*),2-beta,4a-beta,8a-alpha))-
    • (1R,2R,4aS,8aS)-1-((3R)-3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
    • (1R-(1a(R*),2ss,4ass,8aa))-a-Ethylenedecahydro-2-hydroxy-a,2,5,5,8a-pentamethyl-1-naphthalenepropanol; (-)-Sclareol
    • MFCD00869558
    • Sclareol (Standard)
    • Sclareol, 98%
    • Sclareol, analytical standard
    • SCHEMBL873931
    • CHEMBL294740
    • GTPL13431
    • HY-N0128R
    • 1-NAPHTHALENEPROPANOL, .ALPHA.-ETHENYLDECAHYDRO-2-HYDROXY-.ALPHA.,2,5,5,8A-PENTAMETHYL-, (1R-(1.ALPHA.(R*),2.BETA.,4A.BETA.,8A.ALPHA.))-
    • HY-N0128
    • Tox21_302727
    • Sclareol 1000 microg/mL in Acetone
    • AKOS025310185
    • FS74088
    • LMPR0104030010
    • (1R,2R,8aS)-Decahydro-1-(3-hydroxy-3-methyl-4-pentenyl)-2,5,5,8a-tetramethyl-2-naphthol
    • NCGC00256908-01
    • 1-Naphthalenepropanol, .alpha.-ethenyldecahydro-2-hydroxy-.alpha.,2,5,5,8a-pentamethyl-, (.alpha.R,1R,2R,4aS,8aS)-
    • AC-34890
    • AS-14857
    • CAS-515-03-7
    • CS-0007834
    • S0916
    • C09183
    • Q63396017
    • (1R,2R,4As,8aR)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
    • (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methyl-pent-4-enyl]-2,5,5,8a-tetramethyl-decalin-2-ol
    • (1R-(1?(R*),2?,4a?,8a?))-?-Ethylenedecahydro-2-hydroxy-?,2,5,5,8a-pentamethyl-1-naphthalenepropanol; (-)-Sclareol
    • (1R-(1alpha(R*),2beta,4Abeta,8aalpha))-2-hydroxy-alpha,2,5,5,8a-pentamethyl-alpha-vinyldecahydronaphthalene-1-propan-1-ol
    • 1-NAPHTHALENEPROPANOL, alpha-ETHENYLDECAHYDRO-2-HYDROXY-alpha,2,5,5,8A-PENTAMETHYL-, (1R-(1alpha(R*),2beta,4Abeta,8Aalpha))-
    • 1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, (alphaR,1R,2R,4aS,8aS)-
    • 1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-alpha,2,5,5,8a-pentamethyl-, (alphaR,1R,2R,4aS,8aS)-: (1R,2R,4aS,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol
    • 208-194-0
    • UK6
1 3

Thực vật

Tên CAS Thực vật Tỷ lệ
Clary sage (U.S.A.) 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.31%
Clary sage (France) 2 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.15%
Clary sage (Russia) 1 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.15%
Clary sage leaf 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.35%
Clary sage flower 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 3.1%
Vitex agnus-castus leaf (Italy) Vitex agnus-castus L., fam. Verbenaceae 0.3%
Vitex agnus-castus fruit (Italy) Vitex agnus-castus L., fam. Verbenaceae 0.2%
Vitex agnus-castus inflorescence (Italy) Vitex agnus-castus L., fam. Verbenaceae 0.8%
Clary sage (Spain) 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.45%
Cypress, Leyland (Poland) Cupressocyparis leylandii (Dall. et Jacks.) Dall., fam. Cupressaceae 0.3%
Clary sage (Hungary) 1b 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 50.0%
Clary sage (Italy) 2b leaf 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 0.31%
Ducrosia anethifolia (Iran) Ducrosia anethifolia (DC.) Boiss., fam. Apiaceae (Umbelliferae) 6.8%
Salvia aucheri (Turkey) 1a var. aucheri Salvia aucheri Benth. var. aucheri, fam. Lamiaceae (Labiatae) 1.2%