Methymycin

Base Information

• Chemical Name: Methymycin
• CAS No.: 497-72-3
• Molecular Formula: C₂₅H₄₃NO₇
• Molecular Weight: 469.619
• UNII: 16QGD97DXG
• ChEMBL ID: CHEMBL489347
• DSSTox Substance ID: DTXSID801023607
• Metabolomics Workbench ID: 21309
• Nikkaji Number: J39.491B
• Wikidata: Q27110190
• Mol file: 497-72-3.mol

Synonyms:methymycin

Chemical Property of Methymycin

Chemical Property:

• Vapor Pressure: 1.27E-18mmHg at 25°C
• Melting Point: 195.5-197°
• Boiling Point: 631.9°Cat760mmHg
• PKA: pKb 5.7(at 25℃)
• Flash Point: 336°C
• PSA: 105.53000
• Density: 1.13g/cm³
• LogP: 2.30770
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 469.30395271
• Heavy Atom Count: 33
• Complexity: 711

Purity/Quality:

99%, ^*data from raw suppliers

METHYMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1C(C=CC(=O)C(CC(C(C(C(=O)O1)C)OC2C(C(CC(O2)C)N(C)C)O)C)C)(C)O
• Isomeric SMILES: CC[C@@H]1[C@@](/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)C)C)(C)O

Technology Process of Methymycin

There total 4 articles about Methymycin 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: 91.0%

C27H45NO8 (1198600-41-7) → methymycin (497-72-3)

Guidance literature:

With water; triethylamine; In methanol; at 20 ℃; for 3h;

DOI:10.1039/b911200f

Reference yield:

YC-17 (36826-66-1,11091-33-1) → neomethymycin (497-73-4) + methymycin (497-72-3)

Guidance literature:

With potassium dihydrogenphosphate; ethylenediaminetetraacetic acid; NADPH; Rate constant;

DOI:10.1016/S0960-894X(98)00553-8

Reference yield:

YC-17 (36826-66-1,11091-33-1) → methymycin (497-72-3)

Guidance literature:

With potassium dihydrogenphosphate; ethylenediaminetetraacetic acid; NADPH; Equilibrium constant;

DOI:10.1016/S0960-894X(98)00553-8

upstream raw materials:

YC-17

C₂₇H₄₅NO₈

Refernces

• 1、 -. "SELECTIVE OXIDATION OF C-H BONDS OF MODIFIED SUBSTRATES BY P450 MONOOXYGENASE". Page/Page column 14. . Retrieved 2012/07/31.
• 2、 Li, Shengying,Podust, Larissa M.,Sherman, David H.. "Engineering and analysis of a self-sufficient biosynthetic cytochrome P450 PikC fused to the RhFRED reductase domain". . p. 12940 - 12941. Retrieved 2008/09/16.