10-Deoxymethymycin

Base Information

• Chemical Name: 10-Deoxymethymycin
• CAS No.: 36826-66-1
• Molecular Formula: C25H43NO6
• Molecular Weight: 453.612
• ChEMBL ID: CHEMBL326421
• DSSTox Substance ID: DTXSID601100409
• Metabolomics Workbench ID: 21307
• Nikkaji Number: J19.352F
• Wikidata: Q27110232
• Mol file: 36826-66-1.mol

Synonyms:10-Deoxymethymycin;Antibiotic YC 17;YC-17;11091-33-1;CHEBI:29706;(3R,4S,5S,7R,9E,11R,12R)-4-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-12-ethyl-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-dione;36826-66-1;CHEMBL326421;SCHEMBL2729105;DTXSID601100409;LMPK04000035;Q27110232;(3R,4S,5S,7R,9E,11R,12R)-12-ethyl-3,5,7,11-tetramethyl-2,8-dioxooxacyclododec-9-en-4-yl 3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranoside;(3R,4S,5S,7R,9E,11R,12R)-12-Ethyl-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione

Chemical Property of 10-Deoxymethymycin

Chemical Property:

• Boiling Point: 599°Cat760mmHg
• Flash Point: 316°C
• PSA: 85.30000
• Density: 1.09g/cm³
• LogP: 3.19280
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 453.30903809
• Heavy Atom Count: 32
• Complexity: 665

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

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
• Isomeric SMILES: CC[C@@H]1[C@@H](/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

Technology Process of 10-Deoxymethymycin

There total 1 articles about 10-Deoxymethymycin 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:

10-deoxymethynolide (81644-19-1) + TDP α-D-desosamine (294178-48-6) → YC-17 (36826-66-1,11091-33-1)

Guidance literature:

With DesVII-C-His₆; DesVIII; bovine serum albumin; In phosphate buffer; ethanol; glycerol; at 29 ℃; for 18h; pH=8.0;

DOI:10.1021/ja058433v

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:

10-deoxymethynolide

TDP α-D-desosamine

Downstream raw materials:

methymycin

neomethymycin

Refernces