![3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide structure](/static/products/2032/2032-90-8.webp)
3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide
TL;DR: 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide (CAS 2032-90-8) is a chemical compound with molecular formula C30H44O8 and molecular weight 532.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-14-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Acofrioside L, 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide, Carda-4, 3-[(6-deoxy-3-O-methyl-.alpha.-L-mannopyranosyl)oxy]-14-hydroxy-, (3.beta.)-, 3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-14-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, Carda-4,20(22)-dienolide, 3-[(6-deoxy-3-O-methyl-.alpha.-L-mannopyranosyl)oxy]-14-hydroxy-, (3.beta.)-
| Molecular Formula | C30H44O8 |
|---|---|
| Molecular Weight | 532.30 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 532.3036 |
| Heavy Atoms | 38 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 2032-90-8 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3=C2)O)C6=CC(=O)OC6)C)C)O)OC)O |
| InChIKey | BKDRFPSNQMXZKP-UHFFFAOYSA-N |
Product Overview
3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide (CAS 2032-90-8), with molecular formula C30H44O8 and molecular weight 532.30 g/mol. IUPAC: 3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-14-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide
Property Insights of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide. Following Lipinski's Rule of Five, 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide 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-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide?
The CAS number of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide is 2032-90-8.
What is the molecular formula of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide?
The molecular formula of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide is C30H44O8.
What is the molecular weight of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide?
The molecular weight of 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide is 532.30 g/mol.
Where can I buy 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide?
You can request a quote for 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxycarda-4,20(22)-dienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.