beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl
TL;DR: beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl (CAS 97871-80-2) is a chemical compound with molecular formula C11H20N2O8 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[2-methylpropyl(nitroso)amino]methoxy]oxane-2-carboxylic acid
Also Known As: N-Retinoylphenylalanine, KST-1A0154, [(2-methylpropyl)(nitroso)amino]methyl, A-d-glucopyranosiduronic acid, beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl
| Molecular Formula | C11H20N2O8 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.12198 |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 97871-80-2 |
|---|---|
| SMILES | CC(C)CN(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)N=O |
| InChIKey | OSRHGZDGDSHOLU-ZCLKDUABSA-N |
Product Overview
beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl (CAS 97871-80-2), with molecular formula C11H20N2O8 and molecular weight 308.12 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[2-methylpropyl(nitroso)amino]methoxy]oxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl
Property Insights of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl
The XLogP value of -0.4 indicates that beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl has 4 hydrogen bond donor(s) and 10 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 beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl?
The CAS number of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl is 97871-80-2.
What is the molecular formula of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl?
The molecular formula of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl is C11H20N2O8.
What is the molecular weight of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl?
The molecular weight of beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl is 308.12 g/mol.
Where can I buy beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl?
You can request a quote for beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranosiduronic acid, ((2-methylpropyl)nitrosoamino)methyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.