Germinaline
TL;DR: Germinaline (CAS 23211-84-9) is a chemical compound with molecular formula C39H61NO13 and molecular weight 751.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[10,12,14,16,23-pentahydroxy-6,10,19-trimethyl-13-(2-methylbutanoyloxy)-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] 3-acetyloxy-2-hydroxy-2-methylbutanoate
Also Known As: Germinaline, (10,12,14,16,23-pentahydroxy-6,10,19-trimethyl-13-(2-methylbutanoyloxy)-24-oxa-4-azaheptacyclo(12.12.0.02,11.04,9.015,25.018,23.019,25)hexacosan-22-yl) 3-acetyloxy-2-hydroxy-2-methylbutanoate, (1S,2R,6S,9S,10R,11S,12R,13S,14S,15R,16R,18S,19S,22R,23S,25R)-10,12,14,16,23-Pentahydroxy-6,10,19-trimethyl-13-(((2R)-2-methylbutanoyl)oxy)-24-oxa-4-azaheptacyclo(12.12.0.0,.0,.0,.0,.0,)hexacosan-22-yl (2R,3R)-3-(acetyloxy)-2-hydroxy-2-methylbutanoic acid, (1S,2R,6S,9S,10R,11S,12R,13S,14S,15R,16R,18S,19S,22R,23S,25R)-10,12,14,16,23-Pentahydroxy-6,10,19-trimethyl-13-{[(2R)-2-methylbutanoyl]oxy}-24-oxa-4-azaheptacyclo[12.12.0.0,.0,.0,.0,.0,]hexacosan-22-yl (2R,3R)-3-(acetyloxy)-2-hydroxy-2-methylbutanoic acid, [10,12,14,16,23-pentahydroxy-6,10,19-trimethyl-13-(2-methylbutanoyloxy)-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] 3-acetyloxy-2-hydroxy-2-methylbutanoate
| Molecular Formula | C39H61NO13 |
|---|---|
| Molecular Weight | 751.41 g/mol |
| LogP | 1.0364 |
| Topological Polar Surface Area | 212.75 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 751.4143 |
| Heavy Atoms | 53 |
| Complexity | 1504.8076 |
Chemical Identifiers
| CAS Number | 23211-84-9 |
|---|---|
| SMILES | CCC(C)C(=O)OC1C(C2C(CN3CC(CCC3C2(C)O)C)C4C1(C5C(CC6C7(C5(C4)OC6(C(CC7)OC(=O)C(C)(C(C)OC(=O)C)O)O)C)O)O)O |
Product Overview
Germinaline (CAS 23211-84-9), with molecular formula C39H61NO13 and molecular weight 751.41 g/mol. IUPAC: [10,12,14,16,23-pentahydroxy-6,10,19-trimethyl-13-(2-methylbutanoyloxy)-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] 3-acetyloxy-2-hydroxy-2-methylbutanoate.
Chemical Property Profile of Germinaline
Property Insights of Germinaline
The XLogP value of 1.0364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Germinaline. The TPSA of 212.75 Ų indicates high polarity, suggesting Germinaline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Germinaline has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Germinaline?
The CAS number of Germinaline is 23211-84-9.
What is the molecular formula of Germinaline?
The molecular formula of Germinaline is C39H61NO13.
What is the molecular weight of Germinaline?
The molecular weight of Germinaline is 751.41 g/mol.
Where can I buy Germinaline?
You can request a quote for Germinaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Germinaline?
Yes, KEHONG BIO provides custom synthesis services for Germinaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.