(3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one

Base Information

Chemical Name:(3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one
CAS No.:29919-25-3
Molecular Formula:C₃₆H₅₈O₁₀
Molecular Weight:650.851
Hs Code.:
Metabolomics Workbench ID:195292

(3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one

Synonyms:

Suppliers and Price of (3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one

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 4 raw suppliers

Chemical Property of (3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:890.2°Cat760mmHg
Flash Point:270.7°C
PSA：188.14000
Density:1.116g/cm³
LogP:2.79510
XLogP3:4.4
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:1
Exact Mass:650.40299804
Heavy Atom Count:46
Complexity:1020

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1C=CC(CC(CC(CC(CC(CC(CC(C(C(CC=CC=CC=CC=CC=CC(=O)OC1C(C)C)O)C)O)O)O)O)O)O)O
Isomeric SMILES:C[C@H]1/C=C/[C@@H](C[C@@H](C[C@H](C[C@@H](C[C@H](C[C@H](C[C@H]([C@H]([C@H](C/C=C/C=C/C=C/C=C/C=C/C(=O)O[C@H]1C(C)C)O)C)O)O)O)O)O)O)O

Technology Process of (3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one

There total 26 articles about (3E,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one 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: 75.0%

: (+)-mycotycin tetrakis acetonide

: 29919-25-3
flavofungin-I

Guidance literature:: With Dowex H⁺; trimethyleneglycol;
DOI:10.1021/ja00061a057

Reference yield:

: 253432-01-8
{(4R,6R)-6-[(4S,6S)-6-((4R,6R)-6-Hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4-ylmethyl)-2,2-dimethyl-[1,3]dioxan-4-ylmethyl]-2,2-dimethyl-[1,3]dioxan-4-yl}-methanol

: 29919-25-3
flavofungin-I

Guidance literature:: Multi-step reaction with 23 steps

2: RuCl₃, NaIO₄

3: benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate (BOP)

4: 1.) t-BuLi

5: NaBH₄, CeCl₃

6: O₃, 4,6-dimethoxybenzene-1,3-disulfonyl chloride (DMS)

7: pyridine

8: Li/NH₃, NaH₂PO₄

9: H⁺

10: tetrabutylammonium fluoride (TBAF)

13: n-BuLi

14: Ms₂O, pyridine

15: sodium naphthalide

16: tetrabutylammonium fluoride (TBAF)

17: Dess-Martin reagent

18: 2,3-dichloro-5,6-dicyano-1,4-benzoquinone (DDQ)

19: 1.) LHMDS

20: LiOH

21: Et₃N

22: toluene / Heating

23: 75 percent / Dowex H⁺, OHCH₂CH₂CH₂OH

With pyridine; ruthenium trichloride; lithium hydroxide; sodium tetrahydroborate; sodium periodate; sodium dihydrogenphosphate; n-butyllithium; cerium(III) chloride; Dowex H⁺; 4,6-dimethoxybenzene-1,3-bis(sulfonyl) chloride; tetrabutyl ammonium fluoride; ammonia; tert.-butyl lithium; hydrogen cation; lithium; sodium naphthalenide; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; Dess-Martin periodane; ozone; triethylamine; 2,3-dicyano-5,6-dichloro-p-benzoquinone; lithium hexamethyldisilazane; trimethyleneglycol; Methanesulfonic anhydride; In toluene;
DOI:10.1021/ja00061a057

Reference yield:

: C₂₄H₄₀O₆

: 29919-25-3
flavofungin-I

Guidance literature:: Multi-step reaction with 26 steps

1: O₃, 4,6-dimethoxybenzene-1,3-disulfonyl chloride (DMS)

2: K₂CO₃ / methanol

3: NaBH₄

5: RuCl₃, NaIO₄

6: benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate (BOP)

7: 1.) t-BuLi

8: NaBH₄, CeCl₃

9: O₃, 4,6-dimethoxybenzene-1,3-disulfonyl chloride (DMS)

10: pyridine

11: Li/NH₃, NaH₂PO₄

12: H⁺

13: tetrabutylammonium fluoride (TBAF)

16: n-BuLi

17: Ms₂O, pyridine

18: sodium naphthalide

19: tetrabutylammonium fluoride (TBAF)

20: Dess-Martin reagent

21: 2,3-dichloro-5,6-dicyano-1,4-benzoquinone (DDQ)

22: 1.) LHMDS

23: LiOH

24: Et₃N

25: toluene / Heating

26: 75 percent / Dowex H⁺, OHCH₂CH₂CH₂OH

With pyridine; ruthenium trichloride; lithium hydroxide; sodium tetrahydroborate; sodium periodate; sodium dihydrogenphosphate; n-butyllithium; cerium(III) chloride; Dowex H⁺; 4,6-dimethoxybenzene-1,3-bis(sulfonyl) chloride; tetrabutyl ammonium fluoride; ammonia; tert.-butyl lithium; hydrogen cation; lithium; sodium naphthalenide; potassium carbonate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; Dess-Martin periodane; ozone; triethylamine; 2,3-dicyano-5,6-dichloro-p-benzoquinone; lithium hexamethyldisilazane; trimethyleneglycol; Methanesulfonic anhydride; In methanol; toluene;
DOI:10.1021/ja00061a057