Cryptophycin 31

Base Information

Chemical Name:Cryptophycin 31
CAS No.:171674-92-3
Molecular Formula:C₃₅H₄₂Cl₂N₂O₈
Molecular Weight:689.633
Hs Code.:
DSSTox Substance ID:DTXSID401335292
Nikkaji Number:J833.402A
Wikidata:Q77380716
Metabolomics Workbench ID:112490

Synonyms:Cryptophycin 31;Cryptophycin-31;JZEHVSOMRIGJDV-GBGDOJRGSA-N;DTXSID401335292;171674-92-3

Suppliers and Price of Cryptophycin 31

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 Cryptophycin 31

Chemical Property:

XLogP3:6.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:688.2318217
Heavy Atom Count:47
Complexity:1100

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Cryptophycin
Canonical SMILES:CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)C)C(C)C2C(O2)C3=CC=CC=C3)CC4=CC(=C(C(=C4)Cl)OC)Cl
Isomeric SMILES:C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C(=C4)Cl)OC)Cl

Technology Process of Cryptophycin 31

There total 3 articles about Cryptophycin 31 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:

: cryptophycin-23

: 74-88-4
methyl iodide

: 171674-92-3
cryptophycin-31

Guidance literature:: With potassium carbonate; In acetone; at 70 ℃; for 4h;
DOI:10.1021/ja00154a002

Reference yield:

: 124689-65-2
cryptophycin-1

: 168569-15-1
cryptophycin-27

: 171674-92-3
cryptophycin-31

Guidance literature:: cryptophycin-1; With hydrogenchloride; In 1,2-dimethoxyethane; at 20 ℃; for 18h;

With potassium carbonate; In 1,2-dimethoxyethane; for 2h;
DOI:10.1021/np0499665

Reference yield:

: 124689-64-1
cryptophycin C

: 171674-92-3
cryptophycin-31

Guidance literature:: Multi-step reaction with 2 steps

1.1: 1.2 mg / m-chloroperbenzoic acid / CH₂Cl₂ / 2 h / 60 °C

2.1: aq. HCl / 1,2-dimethoxy-ethane / 18 h / 20 °C

2.2: 433 mg / K₂CO₃ / 1,2-dimethoxy-ethane / 2 h

With hydrogenchloride; 3-chloro-benzenecarboperoxoic acid; In 1,2-dimethoxyethane; dichloromethane;
DOI:10.1021/np0499665