Desacetylvinblastine amide

Base Information

• Chemical Name: Desacetylvinblastine amide
• CAS No.: 53643-48-4
• Molecular Formula: C43H55 N5 O7
• Molecular Weight: 753.939
• UNII: RSA8KO39WH
• ChEMBL ID: CHEMBL238071
• NCI Thesaurus Code: C934
• Mol file: 53643-48-4.mol

Synonyms:Compound 112531;Desacetylvinblastine Amide;Eldisine;Enison;NSC 245467;NSC-245467;NSC245467;Sulfate, Vindesine;Vindesin;Vindesine;Vindesine Sulfate

Chemical Property of Desacetylvinblastine amide

Chemical Property:

• Melting Point: 230-232oC
• Boiling Point: °Cat760mmHg
• PKA: pKa (DMF 66%) 5.39, 7.36; (H2O) 6.04, 7.67(at 25℃)
• Flash Point: °C
• PSA: 164.82000
• Density: 1.41g/cm³
• LogP: 3.37350
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 7
• Exact Mass: 753.41014911
• Heavy Atom Count: 55
• Complexity: 1570

Purity/Quality:

98%,99%, ^*data from raw suppliers

Vindesine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(CC2CC(C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)N)O)O)CC)OC)C(=O)OC)O
• Isomeric SMILES: CC[C@@]1(C[C@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)N)O)O)CC)OC)C(=O)OC)O
• Uses: Antineoplastic.
• Therapeutic Function: Antineoplastic

Technology Process of Desacetylvinblastine amide

There total 2 articles about Desacetylvinblastine amide 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:

→ 18-(3-carbamoyl-3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydro-aspidospermidin-15-yl)-4-hydroxy-5,18-seco-ibogamine-18-carboxylic acid methyl ester (53643-48-4)

Guidance literature:

Vinblastinsulfat, 1. NH4OH 2. MeOH, NH3;

DOI:10.1021/jm00199a016

Reference yield:

→ 18-(3-carbamoyl-3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydro-aspidospermidin-15-yl)-4-hydroxy-5,18-seco-ibogamine-18-carboxylic acid methyl ester (53643-48-4)

Guidance literature:

aus C3-carboxhydrazid und NaNO2/HCl, NH3;