Verbascose
TL;DR: Verbascose (CAS 546-62-3) is a chemical compound with molecular formula C30H52O26 and molecular weight 828.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6S)-6-[[(2R,3R,4S,5R,6S)-6-[[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Verbascose, D-Verbascose, Gossypose Pentahydrate, VERBASCOSE [MI], GlyTouCan:G85219WH
| Molecular Formula | C30H52O26 |
|---|---|
| Molecular Weight | 828.27 g/mol |
| LogP | -10.1 |
| Topological Polar Surface Area | 427.0 Ų |
| Hydrogen Bond Donors | 17 |
| Hydrogen Bond Acceptors | 26 |
| Rotatable Bonds | 14 |
| Exact Mass | 828.27466 |
| Heavy Atoms | 56 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 546-62-3 |
|---|---|
| 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)OC[C@@H]3[C@@H]([C@@H]([C@H]([C@H](O3)OC[C@@H]4[C@H]([C@@H]([C@H]([C@H](O4)O[C@]5([C@H]([C@@H]([C@H](O5)CO)O)O)CO)O)O)O)O)O)O)O)O)O)O)O)O)O |
| InChIKey | FLUADVWHMHPUCG-SWPIJASHSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Verbascose (CAS 546-62-3), with molecular formula C30H52O26 and molecular weight 828.27 g/mol. IUPAC: (2S,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6S)-6-[[(2R,3R,4S,5R,6S)-6-[[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Verbascose
Property Insights of Verbascose
The XLogP value of -10.1 indicates that Verbascose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 427.0 Ų indicates high polarity, suggesting Verbascose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Verbascose has 17 hydrogen bond donor(s) and 26 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Verbascose?
The CAS number of Verbascose is 546-62-3.
What is the molecular formula of Verbascose?
The molecular formula of Verbascose is C30H52O26.
What is the molecular weight of Verbascose?
The molecular weight of Verbascose is 828.27 g/mol.
Where can I buy Verbascose?
You can request a quote for Verbascose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Verbascose?
Yes, KEHONG BIO provides custom synthesis services for Verbascose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.