Cas no 83217-89-4 (1β-Hydroxy-β-eudesmol)

1β-Hydroxy-β-eudesmol structure
1β-Hydroxy-β-eudesmol structure
Product Name:1β-Hydroxy-β-eudesmol
CAS No:83217-89-4
MF:C15H26O2
MW:238.365745067596
CID:1080630
PubChem ID:13969455
Update Time:2024-10-27

1β-Hydroxy-β-eudesmol Chemical and Physical Properties

Names and Identifiers

    • 1β-Hydroxy-β-eudesmol
    • (2R,4aR,5R,8aS)-Decahydro-5-hydroxy-α,α,4a-trimethyl-8-methylene-2-naphthalenemethanol (ACI)
    • 2-Naphthalenemethanol, decahydro-5-hydroxy-α,α,4a-trimethyl-8-methylene-, [2R-(2α,4aα,5α,8aβ)]- (ZCI)
    • Eudesma-4(15)-en-1β,11-diol
    • 1beta-Hydroxy-beta-eudesmol
    • 83217-89-4
    • 6-(1-hydroxy-1-methyl-ethyl)-8a-methyl-4-methylene-decahydro-naphthalen-1-ol
    • CHEBI:216298
    • (1S,4aR,6S,8aS)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-ol
    • Ent-4(15)-eudesmen-1alpha,11-diol
    • CHEMBL1079685
    • 1?-Hydroxy-?-eudesmol
    • (1R,4aS,6R,8aR)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-ol
    • AKOS032962698
    • Ent-4(15)-eudesmen-1α,11-diol
    • Inchi： 1S/C15H26O2/c1-10-5-6-13(16)15(4)8-7-11(9-12(10)15)14(2,3)17/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12+,13-,15-/m1/s1
    • InChI Key： MQOLOUZWNJHZLN-QVHKTLOISA-N
    • SMILES： C[C@]12[C@H](O)CCC(=C)[C@@H]1C[C@@H](CC2)C(O)(C)C

Computed Properties

  • Exact Mass: 238.19300
  • Monoisotopic Mass: 238.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 321
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.03±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 152 oC
  • Boiling Point: 344.4±35.0 °C at 760 mmHg
  • Flash Point: 154.6±20.5 °C
  • Solubility: Very slightly soluble (0.17 g/l) (25 o C),
  • PSA: 40.46000
  • LogP: 2.89080
  • Vapor Pressure: 0.0±1.7 mmHg at 25°C

1β-Hydroxy-β-eudesmol Security Information

1β-Hydroxy-β-eudesmol Pricemore >>

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1β-Hydroxy-β-eudesmol Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
1.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 2

Reaction Conditions
1.1 Catalysts: Cytochrome CYP102 Solvents: Water ;  4 h, 37 °C
Reference
Bioconversion of substituted naphthalenes and β-eudesmol with the cytochrome P450 BM3 variant F87V
Misawa, Norihiko; et al, Applied Microbiology and Biotechnology, 2011, 90(1), 147-157

Production Method 3

Reaction Conditions
1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
2.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
2.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 4

Reaction Conditions
1.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
2.1 Reagents: Sodium borohydride Solvents: Ethanol
2.2 Reagents: Acetone
3.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
4.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
4.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 5

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
2.1 Reagents: Dipyridinium dichromate Solvents: Dichloromethane
3.1 Solvents: Pentane
4.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
5.1 Reagents: Oxygen Solvents: Methanol
6.1 Reagents: Silica Solvents: Ethyl acetate
7.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
8.1 Reagents: Sodium borohydride Solvents: Ethanol
8.2 Reagents: Acetone
9.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
10.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
10.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 6

Reaction Conditions
1.1 Reagents: m-Chloroperbenzoic acid Solvents: Chloroform
2.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
3.1 Reagents: Dipyridinium dichromate Solvents: Dichloromethane
4.1 Solvents: Pentane
5.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
6.1 Reagents: Oxygen Solvents: Methanol
7.1 Reagents: Silica Solvents: Ethyl acetate
8.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
9.1 Reagents: Sodium borohydride Solvents: Ethanol
9.2 Reagents: Acetone
10.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
11.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
11.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 7

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Ethanol
1.2 Reagents: Acetone
2.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
3.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
3.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 8

Reaction Conditions
1.1 Reagents: Silica Solvents: Ethyl acetate
2.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
3.1 Reagents: Sodium borohydride Solvents: Ethanol
3.2 Reagents: Acetone
4.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
5.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
5.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 9

Reaction Conditions
1.1 Reagents: Oxygen Solvents: Methanol
2.1 Reagents: Silica Solvents: Ethyl acetate
3.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
4.1 Reagents: Sodium borohydride Solvents: Ethanol
4.2 Reagents: Acetone
5.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
6.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
6.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 10

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
2.1 Reagents: Oxygen Solvents: Methanol
3.1 Reagents: Silica Solvents: Ethyl acetate
4.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
5.1 Reagents: Sodium borohydride Solvents: Ethanol
5.2 Reagents: Acetone
6.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
7.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
7.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 11

Reaction Conditions
1.1 Solvents: Pentane
2.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
3.1 Reagents: Oxygen Solvents: Methanol
4.1 Reagents: Silica Solvents: Ethyl acetate
5.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
6.1 Reagents: Sodium borohydride Solvents: Ethanol
6.2 Reagents: Acetone
7.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
8.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
8.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 12

Reaction Conditions
1.1 Reagents: Dipyridinium dichromate Solvents: Dichloromethane
2.1 Solvents: Pentane
3.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
4.1 Reagents: Oxygen Solvents: Methanol
5.1 Reagents: Silica Solvents: Ethyl acetate
6.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
7.1 Reagents: Sodium borohydride Solvents: Ethanol
7.2 Reagents: Acetone
8.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
9.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
9.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

Production Method 13

Reaction Conditions
1.1 Reagents: Chromium trioxide ,  Sulfuric acid Solvents: Diethyl ether ,  Acetone ,  Water
2.1 Reagents: m-Chloroperbenzoic acid Solvents: Chloroform
3.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
4.1 Reagents: Dipyridinium dichromate Solvents: Dichloromethane
5.1 Solvents: Pentane
6.1 Reagents: Lithium aluminum hydride Solvents: Diethyl ether
7.1 Reagents: Oxygen Solvents: Methanol
8.1 Reagents: Silica Solvents: Ethyl acetate
9.1 Reagents: Magnesium silicate Solvents: Ethyl acetate
10.1 Reagents: Sodium borohydride Solvents: Ethanol
10.2 Reagents: Acetone
11.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol
12.1 Reagents: Sodium hydride Solvents: Dimethyl sulfoxide
12.2 Solvents: Dimethyl sulfoxide
Reference
Total synthesis of (+)-balanitol and of (+)-selin-4-(15)-ene-1β,11-diol
Anglea, Timothy A.; et al, Tetrahedron, 1987, 43(23), 5537-43

1β-Hydroxy-β-eudesmol Raw materials

1β-Hydroxy-β-eudesmol Preparation Products

1β-Hydroxy-β-eudesmol Related Literature

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