Urdamycin E
TL;DR: Urdamycin E (CAS 104542-47-4) is a chemical compound with molecular formula C44H58O17S and molecular weight 890.3395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4aS,12bS)-9-[(2R,4R,5R,6R)-4-[(2S,5S,6S)-5-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]-3,4a,8-trihydroxy-12b-[(2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-5-methylsulfanyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Also Known As: Urdamycin E, Urdamycin-E, (3R,4aS,12bS)-9-[(2R,4R,5R,6R)-4-[(2S,5S,6S)-5-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]-3,4a,8-trihydroxy-12b-[(2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-5-methylsulfanyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione, (3R)-9-[3-O-[(2S)-5alpha-[(2,6-Dideoxy-beta-D-arabino-hexopyranosyl)oxy]tetrahydro-6alpha-methyl-2H-pyran-2beta-yl]-2,6-dideoxy-beta-D-arabino-hexopyranosyl]-3,4,4a,12b-tetrahydro-3alpha,4aalpha,8-trihydroxy-3-methyl-5-methylthio-12balpha-[[(2S)-tetrahydro-5alpha-hydroxy-6alpha-methyl-2H-pyran-2beta-yl]oxy]benz[a]anthracene-1,7,12(2H)-trione, (3R,4aS,12bS)-9-((2R,4R,5R,6R)-4-((2S,5S,6S)-5-((2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl)oxy-5-hydroxy-6-methyloxan-2-yl)-3,4a,8-trihydroxy-12b-((2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl)oxy-3-methyl-5-methylsulfanyl-2,4-dihydrobenzo(a)anthracene-1,7,12-trione
Technical Specifications
| Molecular Formula | C44H58O17S |
| Molecular Weight | 890.3395 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 283.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 8 |
| Exact Mass | 890.3395 Da |
| Heavy Atoms | 62 |
| Complexity | 1810.0 |
| SMILES | C[C@H]1[C@H](CC[C@@H](O1)O[C@]23C(=O)C[C@](C[C@]2(C(=CC4=C3C(=O)C5=C(C4=O)C(=C(C=C5)[C@H]6C[C@H]([C@@H]([C@H](O6)C)O)O[C@H]7CC[C@@H]([C@@H](O7)C)O[C@H]8C[C@H]([C@@H]([C@H](O8)C)O)O)O)SC)O)(C)O)O |
| InChIKey | WDNBUGBJVRAIKE-JGRVRNPESA-N |
Product Description
Applications: Urdamycin E is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Urdamycin E (CAS 104542-47-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, Urdamycin E (CAS 104542-47-4) has the molecular formula C44H58O17S and a molecular weight of 890.34 g/mol. It is also known as Urdamycin E and Urdamycin-E.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Urdamycin E
Property Insights of Urdamycin E
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urdamycin E. The TPSA of 283.0 Ų indicates high polarity, suggesting Urdamycin E may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Urdamycin E has 7 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Urdamycin E?
The CAS number of Urdamycin E is 104542-47-4.
What is the molecular formula of Urdamycin E?
The molecular formula of Urdamycin E is C44H58O17S.
What is the molecular weight of Urdamycin E?
The molecular weight of Urdamycin E is 890.3395 g/mol.
What are the applications of Urdamycin E?
Urdamycin E is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Urdamycin E (CAS 104542-47-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...
Where can I buy Urdamycin E?
You can request a quote for Urdamycin E directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Urdamycin E?
Yes, CoreyChem provides custom synthesis services for Urdamycin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.