Undulatin
TL;DR: Undulatin (CAS 6882-09-3) is a chemical compound with molecular formula C18H21NO5 and molecular weight 331.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,13R,15R,16S,18R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.01,13.02,10.04,8.016,18]icosa-2,4(8),9-triene
Also Known As: Undulatin, 1beta,2beta-Epoxy-3alpha,7-dimethoxycrinan, Crinan, 1,2-epoxy-3,7-dimethoxy-, (1beta,2beta,3alpha)-, (1S,13R,15R,16S,18R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.01,13.02,10.04,8.016,18]icosa-2,4(8),9-triene, (5xi)-3alpha,7-Dimethoxy-1beta,2beta-1,2-epoxycrinan
| Molecular Formula | C18H21NO5 |
|---|---|
| Molecular Weight | 331.14 g/mol |
| LogP | 1.4357 |
| Topological Polar Surface Area | 52.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.14197 |
| Heavy Atoms | 24 |
| Complexity | 736.60956 |
Chemical Identifiers
| CAS Number | 6882-09-3 |
|---|---|
| SMILES | CO[C@@H]1C[C@@H]2[C@@]3(CCN2CC4=C(C5=C(C=C43)OCO5)OC)[C@@H]6[C@H]1O6 |
Product Overview
Undulatin (CAS 6882-09-3), with molecular formula C18H21NO5 and molecular weight 331.14 g/mol. IUPAC: (1S,13R,15R,16S,18R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.01,13.02,10.04,8.016,18]icosa-2,4(8),9-triene.
Chemical Property Profile of Undulatin
Property Insights of Undulatin
The XLogP value of 1.4357 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Undulatin. With a topological polar surface area (TPSA) of 52.69 Ų, Undulatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Undulatin has 0 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 Undulatin?
The CAS number of Undulatin is 6882-09-3.
What is the molecular formula of Undulatin?
The molecular formula of Undulatin is C18H21NO5.
What is the molecular weight of Undulatin?
The molecular weight of Undulatin is 331.14 g/mol.
Where can I buy Undulatin?
You can request a quote for Undulatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undulatin?
Yes, KEHONG BIO provides custom synthesis services for Undulatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.