Epolactaene

Base Information

Chemical Name:Epolactaene
CAS No.:167782-17-4
Molecular Formula:C21H27 N O6
Molecular Weight:389.448
Hs Code.:
UNII:4S7A4HLA92
DSSTox Substance ID:DTXSID301045462
Nikkaji Number:J945.807G
Wikipedia:Epolactaene
Wikidata:Q15410943
ChEMBL ID:CHEMBL183869
Mol file:167782-17-4.mol

Synonyms:epolactaene

Suppliers and Price of Epolactaene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of Epolactaene

Chemical Property:

Vapor Pressure:1.87E-18mmHg at 25°C
Boiling Point:628.9°Cat760mmHg
Flash Point:334.1°C
Density:1.213g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:389.18383758
Heavy Atom Count:28
Complexity:806

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC=C(C=C(C)C=CCCC=C(C)C(=O)C12C(O1)C(NC2=O)(C)O)C(=O)OC
Isomeric SMILES:C/C=C(\C=C(/C)\C=C\CC/C=C(\C)/C(=O)[C@@]12[C@@H](O1)C(NC2=O)(C)O)/C(=O)OC

Technology Process of Epolactaene

There total 68 articles about Epolactaene 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: 78.0%

: 251358-67-5
(12R,13S,14S)-(3E,5E,9E)-methyl 12-carbamoyl-[(2E)-ethylidene]-14-hydroxy-4,10-dimethyl-11-oxo-12,13-epoxy-pentadeca-3,5,9-trienoate

: 167782-17-4
(+)-epolactaene

Guidance literature:: With pyridine-SO₃ complex; dimethyl sulfoxide; triethylamine; In dichloromethane; at 0 ℃; for 2h;
DOI:10.1021/jo025641m

Reference yield: 78.0%

: 239108-30-6
methyl (3E,5E,9E)-11-<(2R,3S)-2-carbamoyl-3-<(R)-1-hydroxyethyl>oxiranyl>-4,10-dimethyl-2-<(E)-ethylidene>-11-oxoundeca-3,5,9-trienoate

: 167782-17-4
(+)-epolactaene

Guidance literature:: With sulfur trioxide pyridine complex; dimethyl sulfoxide; triethylamine; In dichloromethane; at 0 ℃; for 1h;
DOI:10.1246/cl.1998.313

Reference yield:

: 74844-86-3
(E)-7-hydroxy-2-methyl-hept-2-enoic acid ethyl ester

: 167782-17-4
(+)-epolactaene

Guidance literature:: Multi-step reaction with 19 steps

1: 99 percent / imidazole / CH₂Cl₂; dimethylformamide / 0.33 h

2: DIBAL-H / CH₂Cl₂; hexane / 1 h / 0 °C

3: 12.8 g / SO₃*pyridine; Et₃N; DMSO / CH₂Cl₂ / 1.5 h / 0 °C

4: NaH / tetrahydrofuran / 0 °C

5: 269 mg / diisopropylamine; n-BuLi / tetrahydrofuran; hexamethylphosphoric acid triamide; hexane / -78 °C

6: Et₃N / DMAP / CH₂Cl₂ / 1.5 h / 20 °C

7: 3.31 g / DABCO / methanol / 120 h / 100 °C

8: 100 percent / n-Bu₄NF / tetrahydrofuran / 3 h / 0 °C

9: 100 percent / SO₃*pyridine; DMSO; Et₃N / CH₂Cl₂ / 1.5 h / 0 °C

10: 100 percent / n-BuLi / 1,2-dimethoxy-ethane; hexane / 0 - 20 °C

11: 93 percent / n-BuLi / tetrahydrofuran; hexane / 0.02 h / -88 °C

12: CF₃COOH / CH₂Cl₂ / 20 h / 0 - 23 °C

13: 78.0 mg / diethyl ether / -78 °C

14: ethylenediammonium diacetate / benzene / 2 h / 20 °C

15: TrOOH; n-BuLi / tetrahydrofuran; hexane / -78 °C

16: AcOH; NH₄F / tetrahydrofuran; H₂O / 1.5 h / 20 °C

17: silica gel

18: 10.7 mg / NH₄OH / methanol / 0.5 h / 0 °C

19: 78 percent / SO₃*pyridine; DMSO; Et₃N / CH₂Cl₂ / 2 h / 0 °C

With 1,4-diaza-bicyclo[2.2.2]octane; 1H-imidazole; ammonium fluoride; ammonium hydroxide; n-butyllithium; pyridine-SO₃ complex; trityl hydroperoxide; tetrabutyl ammonium fluoride; silica gel; sodium hydride; diisobutylaluminium hydride; acetic acid; dimethyl sulfoxide; ethylenediamine diacetic acid; triethylamine; diisopropylamine; trifluoroacetic acid; dmap; In tetrahydrofuran; methanol; N,N,N,N,N,N-hexamethylphosphoric triamide; 1,2-dimethoxyethane; diethyl ether; hexane; dichloromethane; water; N,N-dimethyl-formamide; benzene; 4: Horner-Emmons reaction / 10: Horner-Emmons reaction / 14: Knoevenagel reaction;
DOI:10.1021/jo025641m