Andromedol
TL;DR: Andromedol (CAS 49784-54-5) is a chemical compound with molecular formula C20H34O6 and molecular weight 370.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3S,4S,6R,8R,9S,10S,13S,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol
Also Known As: Andromedol, grayanotoxin III, Deacylasebotoxin I, tetramethyl[?]hexol, Deacetylandromedotoxin
| Molecular Formula | C20H34O6 |
|---|---|
| Molecular Weight | 370.24 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 370.23553 |
| Heavy Atoms | 26 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 49784-54-5 |
|---|---|
| SMILES | C[C@]1(C[C@]23C[C@@H]([C@@]4([C@H](C[C@H](C4(C)C)O)[C@@]([C@H]2CC[C@H]1[C@@H]3O)(C)O)O)O)O |
| InChIKey | BWMFRQKICHXLSH-ROASOBKTSA-N |
Product Overview
Andromedol (CAS 49784-54-5), with molecular formula C20H34O6 and molecular weight 370.24 g/mol. IUPAC: (1R,3S,4S,6R,8R,9S,10S,13S,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol.
Chemical Property Profile of Andromedol
Property Insights of Andromedol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Andromedol. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Andromedol. Following Lipinski's Rule of Five, Andromedol has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Andromedol?
The CAS number of Andromedol is 49784-54-5.
What is the molecular formula of Andromedol?
The molecular formula of Andromedol is C20H34O6.
What is the molecular weight of Andromedol?
The molecular weight of Andromedol is 370.24 g/mol.
Where can I buy Andromedol?
You can request a quote for Andromedol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Andromedol?
Yes, KEHONG BIO provides custom synthesis services for Andromedol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.