Rosellichalasin

Base Information

• Chemical Name: Rosellichalasin
• CAS No.: 123452-64-2
• Molecular Formula: C₂₈H₃₃NO₅
• Molecular Weight: 463.574
• Mol file: 123452-64-2.mol

Synonyms:Rosellichalasin;123452-64-2;(5Z,10E)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.01,17.013,15]icosa-5,10-diene-3,7,20-trione;C28-H33-N-O5;3H-Oxacyclododecino(2,3-d)oxireno(f)isoindole-5,9,11(4H,8H,12H)-trione, 13,13a,14,14a,15a,15b-hexahydro-4,6,14,14a-tetramethyl-13-(phenylmethyl)-, (4S-(1E,4R*,6E,10aR*,13R*,13aR*,14R*,14aS*,15aR*,15bR*))-

Chemical Property of Rosellichalasin

Chemical Property:

• Vapor Pressure: 2.8E-19mmHg at 25°C
• Boiling Point: 697.1°C at 760 mmHg
• Flash Point: 375.4°C
• Density: 1.23g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 463.23587315
• Heavy Atom Count: 34
• Complexity: 933

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC=CC2C3C(O3)(C(C4C2(C(=O)NC4CC5=CC=CC=C5)OC(=O)CC=C(C1=O)C)C)C
• Isomeric SMILES: CC1C/C=C/C2C3C(O3)(C(C4C2(C(=O)NC4CC5=CC=CC=C5)OC(=O)C/C=C(\C1=O)/C)C)C

Technology Process of Rosellichalasin

There total 2 articles about Rosellichalasin 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:

ketocytochalasin → cytochalasin Z17 + rosellichalasin (123452-64-2)

Guidance literature:

Multi-step reaction with 2 steps

1: NADPH; flavin adenine dinucleotide / aq. phosphate buffer / 25 °C / pH 7.0 / Enzymatic reaction

2: Aspergillus clavatus ΔccsB-37 strain / Enzymatic reaction

With NADPH; flavin adenine dinucleotide; In aq. phosphate buffer;

DOI:10.1038/nchembio.1527

Reference yield:

isoprecytochalasin → cytochalasin Z17 + rosellichalasin (123452-64-2)

Guidance literature:

With Aspergillus clavatus ΔccsB-37 strain; Enzymatic reaction;

DOI:10.1038/nchembio.1527