CID 6438544

Base Information

• Chemical Name: CID 6438544
• CAS No.: 91700-92-4
• Molecular Formula: C₂₉H₄₀N₂O₉
• Molecular Weight: 560.645
• Mol file: 91700-92-4.mol

Synonyms:herbimycin C

Chemical Property of CID 6438544

Chemical Property:

• Vapor Pressure: 1.14E-27mmHg at 25°C
• Boiling Point: 774.1°Cat760mmHg
• Flash Point: 421.9°C
• PSA: 163.48000
• Density: 1.23g/cm³
• LogP: 3.08830
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 560.27338086
• Heavy Atom Count: 40
• Complexity: 1130

Purity/Quality:

>98% by HPLC ^*data from raw suppliers

Herbimycin C ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C=C(C1OC)C2=O)C)OC)OC(=O)N)C)C)O)OC
• Isomeric SMILES: C[C@H]1C[C@H]([C@H]([C@@H](/C=C(/[C@H]([C@@H](/C=C\C=C(\C(=O)NC2=CC(=O)C=C([C@@H]1OC)C2=O)/C)OC)OC(=O)N)\C)C)O)OC
• Uses: Herbimycin C is a minor analogue of the herbimycin complex isolated from Streptomyces hygroscopicus. Herbimycin C possesses potent antitumour activity and converts Rous sarcoma virus-infected rat kidney cells into normal cells. Until now limited access has restricted a full investigation of the properties of herbimycin C. Research on related metabolites, herbimycin A and geldanamycin, has stimulated intensive interest in this class as selective antitumour agents and for prolonging the viability of tissue-cultured cells and organs. Herbimycin C is a minor analog of herbimycin complex.

Technology Process of CID 6438544

There total 1 articles about CID 6438544 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:

herbimycin A (70563-58-5) → Herbimycin C (91700-92-4) + 11-hydroxy-(11-demethoxy)herbimycin C (1208939-02-9)

Guidance literature:

With Eupenicillium sp. SD₀₁₇; In dimethyl sulfoxide; at 28 ℃; for 120h; Enzymatic reaction;

DOI:10.1016/j.molcatb.2009.09.007

upstream raw materials:

herbimycin A

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