轮环藤宁 N-氧化物
TL;DR: 轮环藤宁 N-氧化物 (CAS 85805-55-6) is a chemical compound with molecular formula C38H42N2O7 and molecular weight 638.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
轮环藤宁 N-氧化物
4,5,19,20-tetramethoxy-10,25-dimethyl-10-oxido-2,17-dioxa-25-aza-10-azoniaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(30),3(36),4,6,13(35),14,16(34),18(33),19,21,28,31-dodecaene
Also Known As: Cycleanine N-oxide, 8,11:20,23-Dietheno-1H,12H-(1,10)dioxacyclooctadecino(2,3,4-ij:11,12,13-i'j')diisoquinoline, 2,3,12a,13,14,15,24,24a-octahydro-5,6,17,18-tetramethoxy-1,13-dimethyl-, 1-oxide, (12aR,24aR)-(partial)-, 1~6~,1~7~,5~6~,5~7~-Tetramethoxy-1~2~,5~2~-dimethyl-1~2~-oxo-1~1~,1~2~,1~3~,1~4~,5~1~,5~2~,5~3~,5~4~-octahydro-4,8-dioxa-1(1,8),5(8,1)-diisoquinolina-3,7(1,4)-dibenzenacyclooctaphane, 4,5,19,20-tetramethoxy-10,25-dimethyl-10-oxido-2,17-dioxa-25-aza-10-azoniaheptacyclo(26.2.2.213,16.13,7.118,22.011,36.026,33)hexatriaconta-1(30),3(36),4,6,13(35),14,16(34),18(33),19,21,28,31-dodecaene, 4,5,19,20-tetramethoxy-10,25-dimethyl-10-oxido-2,17-dioxa-25-aza-10-azoniaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(30),3(36),4,6,13(35),14,16(34),18(33),19,21,28,31-dodecaene
| Molecular Formula | C38H42N2O7 |
|---|---|
| Molecular Weight | 638.30 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 638.2992 |
| Heavy Atoms | 47 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 85805-55-6 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC=C(O3)C=C7)[N+](CCC6=CC(=C5OC)OC)(C)[O-])OC)OC |
| InChIKey | BJIBONWGTYBODI-UHFFFAOYSA-N |
Product Overview
轮环藤宁 N-氧化物 (CAS 85805-55-6), with molecular formula C38H42N2O7 and molecular weight 638.30 g/mol. IUPAC: 4,5,19,20-tetramethoxy-10,25-dimethyl-10-oxido-2,17-dioxa-25-aza-10-azoniaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(30),3(36),4,6,13(35),14,16(34),18(33),19,21,28,31-dodecaene.
Chemical Property Profile of 轮环藤宁 N-氧化物
Property Insights of 轮环藤宁 N-氧化物
The XLogP value of 6.1 indicates that 轮环藤宁 N-氧化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 轮环藤宁 N-氧化物. Following Lipinski's Rule of Five, 轮环藤宁 N-氧化物 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 轮环藤宁 N-氧化物?
The CAS number of 轮环藤宁 N-氧化物 is 85805-55-6.
What is the molecular formula of 轮环藤宁 N-氧化物?
The molecular formula of 轮环藤宁 N-氧化物 is C38H42N2O7.
What is the molecular weight of 轮环藤宁 N-氧化物?
The molecular weight of 轮环藤宁 N-氧化物 is 638.30 g/mol.
Where can I buy 轮环藤宁 N-氧化物?
You can request a quote for 轮环藤宁 N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 轮环藤宁 N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 轮环藤宁 N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.