O-β-D-龙胆二糖基-D-(-)-扁桃酰胺
TL;DR: O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 (CAS 66427-91-6) is a chemical compound with molecular formula C20H29NO12 and molecular weight 475.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-β-D-龙胆二糖基-D-(-)-扁桃酰胺
(2R)-2-phenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetamide
Also Known As: O-beta-D-Gentiobiosyl-D-(-)-mandelamide, 2-[(6-O-Hexopyranosylhexopyranosyl)oxy]-2-phenylethanimidic acid, (2R)-[(6-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)ethanimidic acid, (2R)-2-phenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetamide
| Molecular Formula | C20H29NO12 |
|---|---|
| Molecular Weight | 475.17 g/mol |
| LogP | -3.6 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 475.16898 |
| Heavy Atoms | 33 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 66427-91-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)[C@H](C(=O)N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O |
| InChIKey | OCQMNDCGKQJTNY-BFMJJVGDSA-N |
Product Overview
O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 (CAS 66427-91-6), with molecular formula C20H29NO12 and molecular weight 475.17 g/mol. IUPAC: (2R)-2-phenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetamide.
Chemical Property Profile of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺
Property Insights of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺
The XLogP value of -3.6 indicates that O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 222.0 Ų indicates high polarity, suggesting O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺?
The CAS number of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 is 66427-91-6.
What is the molecular formula of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺?
The molecular formula of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 is C20H29NO12.
What is the molecular weight of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺?
The molecular weight of O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 is 475.17 g/mol.
Where can I buy O-β-D-龙胆二糖基-D-(-)-扁桃酰胺?
You can request a quote for O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-β-D-龙胆二糖基-D-(-)-扁桃酰胺?
Yes, KEHONG BIO provides custom synthesis services for O-β-D-龙胆二糖基-D-(-)-扁桃酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.