Spinosine
TL;DR: Spinosine (CAS 175274-51-8) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13aS)-2,3-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-10,11-diol
Also Known As: Spinosine, S-(-)-Spinosine, (-)-Spinosine, (13aS)-2,3-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-10,11-diol, (S)-2,3-Dimethoxy-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-10,11-diol
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 175274-51-8 |
|---|---|
| SMILES | COC1=C(C=C2[C@@H]3CC4=CC(=C(C=C4CN3CCC2=C1)O)O)OC |
| InChIKey | VAKIESMDOCVMDV-HNNXBMFYSA-N |
Product Overview
Spinosine (CAS 175274-51-8), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: (13aS)-2,3-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-10,11-diol.
Chemical Property Profile of Spinosine
Property Insights of Spinosine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spinosine. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Spinosine. Following Lipinski's Rule of Five, Spinosine has 2 hydrogen bond donor(s) and 5 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 Spinosine?
The CAS number of Spinosine is 175274-51-8.
What is the molecular formula of Spinosine?
The molecular formula of Spinosine is C19H21NO4.
What is the molecular weight of Spinosine?
The molecular weight of Spinosine is 327.15 g/mol.
Where can I buy Spinosine?
You can request a quote for Spinosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spinosine?
Yes, KEHONG BIO provides custom synthesis services for Spinosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.