D-5-Ketofructose 1,6-biphosphate
TL;DR: D-5-Ketofructose 1,6-biphosphate (CAS 514-12-5) is a chemical compound with molecular formula C6H12O12P2 and molecular weight 337.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,4S)-3,4-dihydroxy-2,5-dioxo-6-phosphonooxyhexyl] dihydrogen phosphate
Also Known As: D-5-Ketofructose 1,6-biphosphate, KST-1B4660, 1,6-di-o-phosphono-d-threo-hexo-2,5-diulose, 1,6-Di-O-phosphonohexo-2,5-diulose, D-threo-2,5-hexodiulose 1,6-biphosphate
| Molecular Formula | C6H12O12P2 |
|---|---|
| Molecular Weight | 337.98 g/mol |
| LogP | -5.1 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 337.9804 |
| Heavy Atoms | 20 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 514-12-5 |
|---|---|
| SMILES | C(C(=O)[C@H]([C@@H](C(=O)COP(=O)(O)O)O)O)OP(=O)(O)O |
| InChIKey | DFZUTNKDABGQHH-PHDIDXHHSA-N |
Product Overview
D-5-Ketofructose 1,6-biphosphate (CAS 514-12-5), with molecular formula C6H12O12P2 and molecular weight 337.98 g/mol. IUPAC: [(3S,4S)-3,4-dihydroxy-2,5-dioxo-6-phosphonooxyhexyl] dihydrogen phosphate.
Chemical Property Profile of D-5-Ketofructose 1,6-biphosphate
Property Insights of D-5-Ketofructose 1,6-biphosphate
The XLogP value of -5.1 indicates that D-5-Ketofructose 1,6-biphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.0 Ų indicates high polarity, suggesting D-5-Ketofructose 1,6-biphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-5-Ketofructose 1,6-biphosphate has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-5-Ketofructose 1,6-biphosphate?
The CAS number of D-5-Ketofructose 1,6-biphosphate is 514-12-5.
What is the molecular formula of D-5-Ketofructose 1,6-biphosphate?
The molecular formula of D-5-Ketofructose 1,6-biphosphate is C6H12O12P2.
What is the molecular weight of D-5-Ketofructose 1,6-biphosphate?
The molecular weight of D-5-Ketofructose 1,6-biphosphate is 337.98 g/mol.
Where can I buy D-5-Ketofructose 1,6-biphosphate?
You can request a quote for D-5-Ketofructose 1,6-biphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-5-Ketofructose 1,6-biphosphate?
Yes, KEHONG BIO provides custom synthesis services for D-5-Ketofructose 1,6-biphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.