Didemnin C

Base Information

Chemical Name:Didemnin C
CAS No.:77327-06-1
Molecular Formula:C52H82N6O14
Molecular Weight:1015.25
Hs Code.:
UNII:68SK86968R
Wikidata:Q27264273
Metabolomics Workbench ID:140200
ChEMBL ID:CHEMBL505317

Synonyms:didemnin A;didemnin A, N-(1-(2-hydroxy-1-oxopropyl)-L-prolyl)-, (S)-;didemnin A, N-(2-hydroxy-1-oxopropyl)-, (S)-;didemnin B;didemnin C;didemnin D;didemnin E;didemnins;NSC 325319;oncoprecipitin A

Suppliers and Price of Didemnin C

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 2 raw suppliers

Chemical Property of Didemnin C

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:1195.4°Cat760mmHg
Flash Point:676.8°C
PSA：278.06000
Density:1.22g/cm³
LogP:3.73750
XLogP3:5.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:14
Exact Mass:1014.58890131
Heavy Atom Count:72
Complexity:1890

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)C1C(CC(=O)OC(C(=O)C(C(=O)NC(C(=O)N2CCCC2C(=O)N(C(C(=O)OC(C(C(=O)N1)NC(=O)C(CC(C)C)N(C)C(=O)C(C)O)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C)C(C)C)O
Isomeric SMILES:CC[C@H](C)[C@@H]1[C@H](CC(=O)O[C@H](C(=O)[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](C)O)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C)C(C)C)O

Technology Process of Didemnin C

There total 67 articles about Didemnin C 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: 100.0%

: 120286-09-1
Z-didemnin C

: 77327-06-1
didemnin C

Guidance literature:: With hydrogen; palladium on activated charcoal; In isopropyl alcohol; at 20 ℃; for 2h; under 750.06 Torr;
DOI:10.1055/s-1991-26448

Reference yield: 89.0%

: C₅₈H₉₆N₆O₁₄Si

: 77327-06-1
didemnin C

Guidance literature:: With hydrogen fluoride; In acetonitrile; 1.) -15 deg C, 2 h, 2.) 0 deg C, 1 h;
DOI:10.1021/ja00177a030

Reference yield:

: 15761-39-4,59433-50-0
1-(tert-butoxycarbonyl)-L-proline

: 77327-06-1
didemnin C

Guidance literature:: Multi-step reaction with 11 steps

1: 89 percent / EDC / 0 °C

2: 80 percent / H₂ / 10percent Pd/C / acetic acid

3: 89 percent / DMAP, DCC / 0 °C

4: 8N HCl / ethyl acetate / Ambient temperature

5: 40 percent / HOBt, EDC / 0 °C

6: 95 percent / Bu₄N⁽¹⁺⁾*F^(1-) / Ambient temperature

7: 99 percent / TFA-OH / 0 °C

8: 18 percent / NMM, HOBt, EDC / Ambient temperature

9: 88 percent / H₂ / 10percent Pd/C

10: 1.) NaOH, 2.) DCC

11: H₂ / Pd/C

With 4-methyl-morpholine; hydrogenchloride; dmap; sodium hydroxide; tetrabutyl ammonium fluoride; hydrogen; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; dicyclohexyl-carbodiimide; trifluoroacetic acid; palladium on activated charcoal; In acetic acid; ethyl acetate;
DOI:10.1021/ja00256a046