3-O-Rhamnosylchlormadinol acetate
TL;DR: 3-O-Rhamnosylchlormadinol acetate (CAS 6283-09-6) is a chemical compound with molecular formula C29H41ClO8 and molecular weight 552.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: 3-Rcma, 3-O-Rhamnosylchlormadinol acetate, [(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate, 6-chloro-3-[(6-deoxy-, A-l-mannopyranosyl)oxy]-20-oxopregna-4,6-dien-17-yl acetate
| Molecular Formula | C29H41ClO8 |
|---|---|
| Molecular Weight | 552.25 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 552.249 |
| Heavy Atoms | 38 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 6283-09-6 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2CC[C@@]3([C@H]4CC[C@]5([C@H]([C@@H]4C=C(C3=C2)Cl)CC[C@@]5(C(=O)C)OC(=O)C)C)C)O)O)O |
| InChIKey | IUZNXPZMINDWNG-AAUVTORYSA-N |
Product Overview
3-O-Rhamnosylchlormadinol acetate (CAS 6283-09-6), with molecular formula C29H41ClO8 and molecular weight 552.25 g/mol. IUPAC: [(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of 3-O-Rhamnosylchlormadinol acetate
Property Insights of 3-O-Rhamnosylchlormadinol acetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-O-Rhamnosylchlormadinol acetate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-O-Rhamnosylchlormadinol acetate. Following Lipinski's Rule of Five, 3-O-Rhamnosylchlormadinol acetate has 3 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 3-O-Rhamnosylchlormadinol acetate?
The CAS number of 3-O-Rhamnosylchlormadinol acetate is 6283-09-6.
What is the molecular formula of 3-O-Rhamnosylchlormadinol acetate?
The molecular formula of 3-O-Rhamnosylchlormadinol acetate is C29H41ClO8.
What is the molecular weight of 3-O-Rhamnosylchlormadinol acetate?
The molecular weight of 3-O-Rhamnosylchlormadinol acetate is 552.25 g/mol.
Where can I buy 3-O-Rhamnosylchlormadinol acetate?
You can request a quote for 3-O-Rhamnosylchlormadinol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O-Rhamnosylchlormadinol acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-O-Rhamnosylchlormadinol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.