RefChem:1100602
TL;DR: RefChem:1100602 (CAS 101627-57-0) is a chemical compound with molecular formula C32H53NO10 and molecular weight 611.36694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(11Z,13E)-6-[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-(1-hydroxyethyl)-5,9,13-trimethyl-2,10-dioxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
Also Known As: Tylonolide, 14-de(hydroxymethyl)-5-O-(3,6-dideoxy-3-(dimethylamino)-beta-D-glucopyranosyl)-14-(1-hydroxyethyl)-, (14(R))-, 2-[(11Z,13E)-6-[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-(1-hydroxyethyl)-5,9,13-trimethyl-2,10-dioxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde, Tylonolide, 14-de(hydroxymethyl)-5-O-(3,6-dideoxy-3-(dimethylamino)-beta-D-glucopyranosyl)-14-(1-hydroxyethyl)-, (14(S))-
Technical Specifications
| Molecular Formula | C32H53NO10 |
| Molecular Weight | 611.36694 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 163.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 611.36694 Da |
| Heavy Atoms | 43 |
| Complexity | 983.0 |
| SMILES | CCC1C(/C=C(/C=C\C(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)O)N(C)C)O)CC=O)C)\C)C(C)O |
| InChIKey | BIUOCAGCXPTSJW-DGLSXKDYSA-N |
Chemical Property Profile of RefChem:1100602
Property Insights of RefChem:1100602
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1100602. The TPSA of 163.0 Ų indicates high polarity, suggesting RefChem:1100602 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1100602 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1100602?
The CAS number of RefChem:1100602 is 101627-57-0.
What is the molecular formula of RefChem:1100602?
The molecular formula of RefChem:1100602 is C32H53NO10.
What is the molecular weight of RefChem:1100602?
The molecular weight of RefChem:1100602 is 611.36694 g/mol.
Where can I buy RefChem:1100602?
You can request a quote for RefChem:1100602 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1100602?
Yes, CoreyChem provides custom synthesis services for RefChem:1100602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.