Sonomolide A
TL;DR: Sonomolide A (CAS 172486-70-3) is a chemical compound with molecular formula C20H28O4 and molecular weight 332.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,6S,7R,9R,12S,13S,16S)-6-ethenyl-13,16-dihydroxy-1,12-dimethyl-5-methylidene-10-oxatetracyclo[7.6.1.02,7.012,16]hexadecan-11-one
Also Known As: Sonomolide A, dihydroxy-dimethyl-methylene-vinyl-[?]one, 4H-Phenanthro(10,1-bc)furan-4-one, 7-ethenyltetradecahydro-3,10c-dihydroxy-3a,10b-dimethyl-8-methylene-, (3R,3aR,5aS,6aS,7R,10aR,10bS,10cR)-rel-(+)-, (1R,2S,6S,7R,9R,12S,13S,16S)-6-ethenyl-13,16-dihydroxy-1,12-dimethyl-5-methylidene-10-oxatetracyclo[7.6.1.02,7.012,16]hexadecan-11-one, 14-Ethenyl-3,5-dihydroxy-13-methylidene-6,15-epoxypodocarpan-15-one
| Molecular Formula | C20H28O4 |
|---|---|
| Molecular Weight | 332.20 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.19876 |
| Heavy Atoms | 24 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 172486-70-3 |
|---|---|
| SMILES | C[C@]12CC[C@@H]([C@]3([C@@]1([C@@H](C[C@@H]4[C@@H]2CCC(=C)[C@H]4C=C)OC3=O)O)C)O |
| InChIKey | IRMOTGCMHMASFO-IQDQMAIWSA-N |
Product Overview
Sonomolide A (CAS 172486-70-3), with molecular formula C20H28O4 and molecular weight 332.20 g/mol. IUPAC: (1R,2S,6S,7R,9R,12S,13S,16S)-6-ethenyl-13,16-dihydroxy-1,12-dimethyl-5-methylidene-10-oxatetracyclo[7.6.1.02,7.012,16]hexadecan-11-one.
Chemical Property Profile of Sonomolide A
Property Insights of Sonomolide A
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sonomolide A. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Sonomolide A. Following Lipinski's Rule of Five, Sonomolide A has 2 hydrogen bond donor(s) and 4 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 Sonomolide A?
The CAS number of Sonomolide A is 172486-70-3.
What is the molecular formula of Sonomolide A?
The molecular formula of Sonomolide A is C20H28O4.
What is the molecular weight of Sonomolide A?
The molecular weight of Sonomolide A is 332.20 g/mol.
Where can I buy Sonomolide A?
You can request a quote for Sonomolide A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sonomolide A?
Yes, KEHONG BIO provides custom synthesis services for Sonomolide A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.