马兜铃内酰胺葡萄糖苷
TL;DR: 马兜铃内酰胺葡萄糖苷 (CAS 20852-38-4) is a chemical compound with molecular formula C23H21NO9 and molecular weight 455.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
马兜铃内酰胺葡萄糖苷
14-methoxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,5-dioxa-10-azapentacyclo[9.7.1.02,6.08,19.013,18]nonadeca-1(18),2(6),7,11(19),12,14,16-heptaen-9-one
Also Known As: Aristololactam-glucoside, Aristolactam-N-beta-D-glycoside, aristolactam-N-, A-D-glucoside, aristolactam I-N-
| Molecular Formula | C23H21NO9 |
|---|---|
| Molecular Weight | 455.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 455.12164 |
| Heavy Atoms | 33 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 20852-38-4 |
|---|---|
| SMILES | COC1=CC=CC2=C3C4=C(C=C21)N(C(=O)C4=CC5=C3OCO5)[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O |
| InChIKey | GIDCUQKCIZAUKW-AUJACXKFSA-N |
Product Overview
马兜铃内酰胺葡萄糖苷 (CAS 20852-38-4), with molecular formula C23H21NO9 and molecular weight 455.12 g/mol. IUPAC: 14-methoxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,5-dioxa-10-azapentacyclo[9.7.1.02,6.08,19.013,18]nonadeca-1(18),2(6),7,11(19),12,14,16-heptaen-9-one.
Chemical Property Profile of 马兜铃内酰胺葡萄糖苷
Property Insights of 马兜铃内酰胺葡萄糖苷
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 马兜铃内酰胺葡萄糖苷. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 马兜铃内酰胺葡萄糖苷. Following Lipinski's Rule of Five, 马兜铃内酰胺葡萄糖苷 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 马兜铃内酰胺葡萄糖苷?
The CAS number of 马兜铃内酰胺葡萄糖苷 is 20852-38-4.
What is the molecular formula of 马兜铃内酰胺葡萄糖苷?
The molecular formula of 马兜铃内酰胺葡萄糖苷 is C23H21NO9.
What is the molecular weight of 马兜铃内酰胺葡萄糖苷?
The molecular weight of 马兜铃内酰胺葡萄糖苷 is 455.12 g/mol.
Where can I buy 马兜铃内酰胺葡萄糖苷?
You can request a quote for 马兜铃内酰胺葡萄糖苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 马兜铃内酰胺葡萄糖苷?
Yes, KEHONG BIO provides custom synthesis services for 马兜铃内酰胺葡萄糖苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.