Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-
TL;DR: Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- (CAS 23984-18-1) is a chemical compound with molecular formula C23H36O6 and molecular weight 408.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,4R,6S,8S,10S,14R,16S)-3,4,6,14-tetrahydroxy-5,5,14-trimethyl-9-methylidene-16-tetracyclo[11.2.1.01,10.04,8]hexadecanyl] propanoate
Also Known As: Asebotoxin II, KST-1A3395, (3, A,6, A,14s)-3,5,6,16-tetrahydroxygrayanotox-10-en-14-yl propanoate
| Molecular Formula | C23H36O6 |
|---|---|
| Molecular Weight | 408.25 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.2512 |
| Heavy Atoms | 29 |
| Complexity | 733.0 |
Chemical Identifiers
| CAS Number | 23984-18-1 |
|---|---|
| SMILES | CCC(=O)O[C@H]1C2CC[C@@H]3C1(C[C@H]([C@]4([C@H](C3=C)C[C@@H](C4(C)C)O)O)O)C[C@@]2(C)O |
| InChIKey | VVXZWGWGAMWPOU-AQSUQCSSSA-N |
Product Overview
Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- (CAS 23984-18-1), with molecular formula C23H36O6 and molecular weight 408.25 g/mol. IUPAC: [(3R,4R,6S,8S,10S,14R,16S)-3,4,6,14-tetrahydroxy-5,5,14-trimethyl-9-methylidene-16-tetracyclo[11.2.1.01,10.04,8]hexadecanyl] propanoate.
Chemical Property Profile of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-
Property Insights of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-. Following Lipinski's Rule of Five, Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- has 4 hydrogen bond donor(s) and 6 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 Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-?
The CAS number of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- is 23984-18-1.
What is the molecular formula of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-?
The molecular formula of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- is C23H36O6.
What is the molecular weight of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-?
The molecular weight of Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- is 408.25 g/mol.
Where can I buy Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-?
You can request a quote for Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)-?
Yes, KEHONG BIO provides custom synthesis services for Grayanotox-10(20)-ene-3,5,6,14,16-pentol, 14-propanoate, (3beta,6beta,14R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.