D-glycero-D-altro-Octulose 1,8-bisphosphate
TL;DR: D-glycero-D-altro-Octulose 1,8-bisphosphate (CAS 16958-95-5) is a chemical compound with molecular formula C8H18O14P2 and molecular weight 400.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4R,5R,6S)-2,3,4,5,6-pentahydroxy-7-oxo-8-phosphonooxyoctyl] dihydrogen phosphate
Also Known As: D-glycero-D-altro-Octulose 1,8-bisphosphate, 1,8-Di-O-phosphonooct-2-ulose, Cid 130470, KST-1B0920, 1,8-di-o-phosphono-l-glycero-d-altro-oct-2-ulose
| Molecular Formula | C8H18O14P2 |
|---|---|
| Molecular Weight | 400.02 g/mol |
| LogP | -6.7 |
| Topological Polar Surface Area | 252.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 11 |
| Exact Mass | 400.01718 |
| Heavy Atoms | 24 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 16958-95-5 |
|---|---|
| SMILES | C([C@@H]([C@H]([C@H]([C@H]([C@@H](C(=O)COP(=O)(O)O)O)O)O)O)O)OP(=O)(O)O |
| InChIKey | FQNLKWXILWAYPZ-RMJYWKLSSA-N |
Product Overview
D-glycero-D-altro-Octulose 1,8-bisphosphate (CAS 16958-95-5), with molecular formula C8H18O14P2 and molecular weight 400.02 g/mol. IUPAC: [(2S,3R,4R,5R,6S)-2,3,4,5,6-pentahydroxy-7-oxo-8-phosphonooxyoctyl] dihydrogen phosphate.
Chemical Property Profile of D-glycero-D-altro-Octulose 1,8-bisphosphate
Property Insights of D-glycero-D-altro-Octulose 1,8-bisphosphate
The XLogP value of -6.7 indicates that D-glycero-D-altro-Octulose 1,8-bisphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 252.0 Ų indicates high polarity, suggesting D-glycero-D-altro-Octulose 1,8-bisphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-glycero-D-altro-Octulose 1,8-bisphosphate has 9 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 D-glycero-D-altro-Octulose 1,8-bisphosphate?
The CAS number of D-glycero-D-altro-Octulose 1,8-bisphosphate is 16958-95-5.
What is the molecular formula of D-glycero-D-altro-Octulose 1,8-bisphosphate?
The molecular formula of D-glycero-D-altro-Octulose 1,8-bisphosphate is C8H18O14P2.
What is the molecular weight of D-glycero-D-altro-Octulose 1,8-bisphosphate?
The molecular weight of D-glycero-D-altro-Octulose 1,8-bisphosphate is 400.02 g/mol.
Where can I buy D-glycero-D-altro-Octulose 1,8-bisphosphate?
You can request a quote for D-glycero-D-altro-Octulose 1,8-bisphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-glycero-D-altro-Octulose 1,8-bisphosphate?
Yes, KEHONG BIO provides custom synthesis services for D-glycero-D-altro-Octulose 1,8-bisphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.