Deoxyspergualin

Base Information

Chemical Name:Deoxyspergualin
CAS No.:89149-10-0
Molecular Formula:C₁₇H₃₇N₇O₃
Molecular Weight:387.526
Hs Code.:
UNII:57F9XM233R
DSSTox Substance ID:DTXSID70237548
Nikkaji Number:J209.343J
Wikidata:Q27261503
Metabolomics Workbench ID:153873
ChEMBL ID:CHEMBL1172736
Mol file:89149-10-0.mol

Synonyms:1-amino-19-guanidino-11-hydroxy-4,9,12-triazanonadecane-10,13-dione;15-deoxyspergualin;deoxyspergualin;gusperimus;gusperimus trihydrochloride;gusperimus, (+-)-isomer;NKT-01

Suppliers and Price of Deoxyspergualin

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

American Custom Chemicals Corporation
7-[(AMINOIMINOMETHYL)AMINO]-N-[(1S)-2-[[4-[(3-AMINOPROPYL)AMINO]BUTYL]AMINO]-1-HYDROXY-2-OXOETHYL]HEPTANAMIDE 95.00%
5MG
$ 497.18

Total 5 raw suppliers

Chemical Property of Deoxyspergualin

Chemical Property:

PSA：178.38000
LogP:1.75330
XLogP3:-2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:17
Exact Mass:387.29578807
Heavy Atom Count:27
Complexity:429

Purity/Quality:

95% ^*data from raw suppliers

7-[(AMINOIMINOMETHYL)AMINO]-N-[(1S)-2-[[4-[(3-AMINOPROPYL)AMINO]BUTYL]AMINO]-1-HYDROXY-2-OXOETHYL]HEPTANAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(CCCN=C(N)N)CCC(=O)NC(C(=O)NCCCCNCCCN)O
Isomeric SMILES:C(CCCN=C(N)N)CCC(=O)N[C@H](C(=O)NCCCCNCCCN)O
Recent ClinicalTrials:Peritransplant Deoxyspergualin in Islet Transplantation in Type 1 Diabetes

Technology Process of Deoxyspergualin

There total 8 articles about Deoxyspergualin 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: 71.0%