桑甾酮A
TL;DR: 桑甾酮A (CAS 38778-30-2) is a chemical compound with molecular formula C27H44O8 and molecular weight 496.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
桑甾酮A
17-(2,3-dihydroxy-6-methylheptan-2-yl)-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
Also Known As: muristerone a, Muristerone, (2S,3R,5S,9R,10R,11R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl]-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one, 17-(1,2-dihydroxy-1,5-dimethyl-hexyl)-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one, 17-(2,3-dihydroxy-6-methylheptan-2-yl)-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
| Molecular Formula | C27H44O8 |
|---|---|
| Molecular Weight | 496.30 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.30362 |
| Heavy Atoms | 35 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 38778-30-2 |
|---|---|
| SMILES | CC(C)CCC(C(C)(C1CCC2(C1(CC(C3C2=CC(=O)C4(C3(CC(C(C4)O)O)C)O)O)C)O)O)O |
| InChIKey | LRJUYAVTHIEHAI-UHFFFAOYSA-N |
Product Overview
桑甾酮A (CAS 38778-30-2), with molecular formula C27H44O8 and molecular weight 496.30 g/mol. IUPAC: 17-(2,3-dihydroxy-6-methylheptan-2-yl)-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one.
Chemical Property Profile of 桑甾酮A
Property Insights of 桑甾酮A
The XLogP value of -0.1 indicates that 桑甾酮A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.0 Ų indicates high polarity, suggesting 桑甾酮A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 米乐甾酮A has 7 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 米乐甾酮A?
The CAS number of 米乐甾酮A is 38778-30-2.
What is the molecular formula of 米乐甾酮A?
The molecular formula of 米乐甾酮A is C27H44O8.
What is the molecular weight of 米乐甾酮A?
The molecular weight of 米乐甾酮A is 496.30 g/mol.
Where can I buy 米乐甾酮A?
You can request a quote for 米乐甾酮A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 米乐甾酮A?
Yes, KEHONG BIO provides custom synthesis services for 米乐甾酮A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.