(-)-Rabdoternin A
TL;DR: (-)-Rabdoternin A (CAS 128887-80-9) is a chemical compound with molecular formula C20H28O6 and molecular weight 364.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,5S,7R,8R,9S,10S,11R,18R)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one
Also Known As: Rabdoternin A, (-)-Rabdoternin A, (1R,2R,5S,7R,8R,9S,10S,11R,18R)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one, 6,7,14,15-Tetrahydroxy-7,20-epoxykaur-16-en-20-one, Kaur-16-en-20-oic acid, 6,7,7,14,15-pentahydroxy-, 20,7-lactone, (6beta,7alpha,14R,15beta)-
| Molecular Formula | C20H28O6 |
|---|---|
| Molecular Weight | 364.19 g/mol |
| LogP | 0.7232 |
| Topological Polar Surface Area | 107.22 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 364.1886 |
| Heavy Atoms | 26 |
| Complexity | 717.08997 |
Chemical Identifiers
| CAS Number | 128887-80-9 |
|---|---|
| SMILES | CC1(CCC[C@]23[C@@H]1[C@@H]([C@]([C@]45[C@H]2CC[C@H]([C@H]4O)C(=C)[C@H]5O)(OC3=O)O)O)C |
Product Overview
(-)-Rabdoternin A (CAS 128887-80-9), with molecular formula C20H28O6 and molecular weight 364.19 g/mol. IUPAC: (1R,2R,5S,7R,8R,9S,10S,11R,18R)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one.
Chemical Property Profile of (-)-Rabdoternin A
Property Insights of (-)-Rabdoternin A
The XLogP value of 0.7232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-Rabdoternin A. The TPSA of 107.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-Rabdoternin A. Following Lipinski's Rule of Five, (-)-Rabdoternin A 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 (-)-Rabdoternin A?
The CAS number of (-)-Rabdoternin A is 128887-80-9.
What is the molecular formula of (-)-Rabdoternin A?
The molecular formula of (-)-Rabdoternin A is C20H28O6.
What is the molecular weight of (-)-Rabdoternin A?
The molecular weight of (-)-Rabdoternin A is 364.19 g/mol.
Where can I buy (-)-Rabdoternin A?
You can request a quote for (-)-Rabdoternin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-Rabdoternin A?
Yes, KEHONG BIO provides custom synthesis services for (-)-Rabdoternin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.