fagopyritol B2
TL;DR: fagopyritol B2 (CAS 116261-02-0) is a chemical compound with molecular formula C18H32O16 and molecular weight 504.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,4R,5S)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol
Also Known As: fagopyritol B2, Sid 768671, J1.379.495B, D-chiro-Inositol, O-.alpha.-D-galactopyranosyl-(1?6)-O-.alpha.-D-galactopyranosyl-(1?2)-, (1S,2R,4R,5S)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol
| Molecular Formula | C18H32O16 |
|---|---|
| Molecular Weight | 504.17 g/mol |
| LogP | -8.1862 |
| Topological Polar Surface Area | 279.68 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.16904 |
| Heavy Atoms | 34 |
| Complexity | 637.44293 |
Chemical Identifiers
| CAS Number | 116261-02-0 |
|---|---|
| SMILES | C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)OC3[C@H]([C@@H](C([C@H]([C@@H]3O)O)O)O)O)O)O)O)O)O)O)O |
Product Overview
fagopyritol B2 (CAS 116261-02-0), with molecular formula C18H32O16 and molecular weight 504.17 g/mol. IUPAC: (1S,2R,4R,5S)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol.
Chemical Property Profile of fagopyritol B2
Property Insights of fagopyritol B2
The XLogP value of -8.1862 indicates that fagopyritol B2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 279.68 Ų indicates high polarity, suggesting fagopyritol B2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, fagopyritol B2 has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of fagopyritol B2?
The CAS number of fagopyritol B2 is 116261-02-0.
What is the molecular formula of fagopyritol B2?
The molecular formula of fagopyritol B2 is C18H32O16.
What is the molecular weight of fagopyritol B2?
The molecular weight of fagopyritol B2 is 504.17 g/mol.
Where can I buy fagopyritol B2?
You can request a quote for fagopyritol B2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for fagopyritol B2?
Yes, KEHONG BIO provides custom synthesis services for fagopyritol B2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.