磁麻苷
TL;DR: 磁麻苷 (CAS 508-77-0) is a chemical compound with molecular formula C30H44O9 and molecular weight 548.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磁麻苷
(3S,5S)-5,14-dihydroxy-3-[(2R,4S,5R,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
Also Known As: Cymarine, Tsimarin, Zimarin, Alvonal MR, h-Strophanthin
| Molecular Formula | C30H44O9 |
|---|---|
| Molecular Weight | 548.30 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 548.2985 |
| Heavy Atoms | 39 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 508-77-0 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CCC3(C4CCC5(C(CCC5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O |
| InChIKey | XQCGNURMLWFQJR-HLPDFKCVSA-N |
Product Overview
磁麻苷 (CAS 508-77-0), with molecular formula C30H44O9 and molecular weight 548.30 g/mol. IUPAC: (3S,5S)-5,14-dihydroxy-3-[(2R,4S,5R,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde.
Chemical Property Profile of 磁麻苷
Property Insights of 磁麻苷
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 磁麻苷. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 磁麻苷. Following Lipinski's Rule of Five, 磁麻苷 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 磁麻苷?
The CAS number of 磁麻苷 is 508-77-0.
What is the molecular formula of 磁麻苷?
The molecular formula of 磁麻苷 is C30H44O9.
What is the molecular weight of 磁麻苷?
The molecular weight of 磁麻苷 is 548.30 g/mol.
Where can I buy 磁麻苷?
You can request a quote for 磁麻苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磁麻苷?
Yes, KEHONG BIO provides custom synthesis services for 磁麻苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.