Dipterocarpol

Base Information

• Chemical Name: Dipterocarpol
• CAS No.: 471-69-2
• Molecular Formula: C₃₀H₅₀O₂
• Molecular Weight: 442.726
• DSSTox Substance ID: DTXSID60963743
• Nikkaji Number: J12.040E
• Wikidata: Q27106428
• ChEMBL ID: CHEMBL224816
• Mol file: 471-69-2.mol

Synonyms:Dipterocarpol;471-69-2;Dipterocaprol;CHEBI:4652;hydroxydammarenone II;(5R,8R,9R,10R,13R,14R,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;Dipterocarpol, 98%;CHEMBL224816;SCHEMBL2474520;20-Hydroxydammar-24-en-3-one;DTXSID60963743;HY-N3769;AKOS015916003;CCG-208468;CS-0024189;C08622;SR-05000002228;SR-05000002228-2;Q27106428

Chemical Property of Dipterocarpol

Chemical Property:

• Vapor Pressure: 2.54E-13mmHg at 25°C
• Melting Point: 133-135 °C(lit.)
• Refractive Index: 1.511
• Boiling Point: 527.3 °C at 760 mmHg
• PKA: 15.06±0.29(Predicted)
• Flash Point: 222.6 °C
• PSA: 37.30000
• Density: 0.99 g/cm³
• LogP: 7.73800
• XLogP3: 8.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 442.381080833
• Heavy Atom Count: 32
• Complexity: 791

Purity/Quality:

98%min ^*data from raw suppliers

Dipterocarpol ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1CCC3C2(CCC4C3(CCC(=O)C4(C)C)C)C)C)O)C
• Isomeric SMILES: CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1CC[C@H]3[C@]2(CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O)C
• Uses: Dipterocarpol is an extract from Dipterocarpol alatus, an antibacterial against methicillin-resistant staphylococcus aureus (mrsa). Dipterocarpus has been used for the treatment of external wounds and skin diseases in traditional medicine.

Technology Process of Dipterocarpol

There total 2 articles about Dipterocarpol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ 3-Keto-20(R)-hydroxydammar-24-en (471-69-2,19222-66-3,22549-23-1,33426-06-1,114926-00-0)

Guidance literature:

3β,20(R)-Dihydroxydammar-24-en (1), CrO3/H2SO4;

DOI:10.1016/S0031-9422(00)94444-3

Reference yield:

→ 20-Hydroxy-dammaren-24-on-3 (471-69-2,19222-66-3,22549-23-1,33426-06-1,114926-00-0)

Guidance literature:

Dammaren-diol-3β,20, CrO3, Acn., wss. H2SO4;

Reference yield: 96.0%

dipterocarpol (471-69-2) → dammarenediol II (14351-29-2)

Guidance literature:

With sodium tetrahydroborate; In ethanol; for 4h; Reflux;

DOI:10.1007/s10600-013-0505-4

Downstream raw materials:

dammarenediol II

cabralelactone

dammadienone

C₃₈H₅₆O₅