Ganoine
TL;DR: Ganoine (CAS 133086-80-3) is a chemical compound with molecular formula C11H17NO2 and molecular weight 195.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(hydroxymethyl)-1-(3-methylbutyl)pyrrole-2-carbaldehyde
Also Known As: Ganoine, Ganoderma alkaloid A, N-Isopentyl-5-hydroxymethylpyrryl aldehyde, 1-Isopentyl-2-formyl-5-hydroxymethylpyrrole, 5-(hydroxymethyl)-1-(3-methylbutyl)pyrrole-2-carbaldehyde
| Molecular Formula | C11H17NO2 |
|---|---|
| Molecular Weight | 195.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 195.12593 |
| Heavy Atoms | 14 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 133086-80-3 |
|---|---|
| SMILES | CC(C)CCN1C(=CC=C1C=O)CO |
| InChIKey | QFUKUPZJJSMEGE-UHFFFAOYSA-N |
Product Overview
Ganoine (CAS 133086-80-3), with molecular formula C11H17NO2 and molecular weight 195.13 g/mol. IUPAC: 5-(hydroxymethyl)-1-(3-methylbutyl)pyrrole-2-carbaldehyde.
Chemical Property Profile of Ganoine
Property Insights of Ganoine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ganoine. With a topological polar surface area (TPSA) of 42.2 Ų, Ganoine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ganoine has 1 hydrogen bond donor(s) and 2 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 Ganoine?
The CAS number of Ganoine is 133086-80-3.
What is the molecular formula of Ganoine?
The molecular formula of Ganoine is C11H17NO2.
What is the molecular weight of Ganoine?
The molecular weight of Ganoine is 195.13 g/mol.
Where can I buy Ganoine?
You can request a quote for Ganoine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ganoine?
Yes, KEHONG BIO provides custom synthesis services for Ganoine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.