Trigoneoside VIII
TL;DR: Trigoneoside VIII (CAS 425644-95-7) is a chemical compound with molecular formula C44H72O18 and molecular weight 888.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R)-4-[(1R,2S,4S,8S,9S,12S,13S,15R,16R,18S)-15-hydroxy-7,9,13-trimethyl-16-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-6-en-6-yl]-2-methylbutoxy]oxane-3,4,5-triol
Also Known As: Trigoneoside VIII, I(2)-D-Glucopyranoside, (2I+/-,3I(2),5I+/-,25R)-26-(I(2)-D-glucopyranosyloxy)-2-hydroxyfurost-20(22)-en-3-yl 6-O-I(2)-D-xylopyranosyl-
| Molecular Formula | C44H72O18 |
|---|---|
| Molecular Weight | 888.47 g/mol |
| LogP | -1.22 |
| Topological Polar Surface Area | 287.14 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 12 |
| Exact Mass | 888.47186 |
| Heavy Atoms | 62 |
| Complexity | 1568.734 |
Chemical Identifiers
| CAS Number | 425644-95-7 |
|---|---|
| SMILES | CC1=C(O[C@@H]2[C@H]1[C@]3(CC[C@H]4[C@H]([C@@H]3C2)CC[C@@H]5[C@@]4(C[C@H]([C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)O)O)O)O)C)C)CC[C@@H](C)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O |
Product Overview
Trigoneoside VIII (CAS 425644-95-7), with molecular formula C44H72O18 and molecular weight 888.47 g/mol. IUPAC: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R)-4-[(1R,2S,4S,8S,9S,12S,13S,15R,16R,18S)-15-hydroxy-7,9,13-trimethyl-16-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-6-en-6-yl]-2-methylbutoxy]oxane-3,4,5-triol.
Chemical Property Profile of Trigoneoside VIII
Property Insights of Trigoneoside VIII
The XLogP value of -1.22 indicates that Trigoneoside VIII is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 287.14 Ų indicates high polarity, suggesting Trigoneoside VIII may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trigoneoside VIII has 11 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trigoneoside VIII?
The CAS number of Trigoneoside VIII is 425644-95-7.
What is the molecular formula of Trigoneoside VIII?
The molecular formula of Trigoneoside VIII is C44H72O18.
What is the molecular weight of Trigoneoside VIII?
The molecular weight of Trigoneoside VIII is 888.47 g/mol.
Where can I buy Trigoneoside VIII?
You can request a quote for Trigoneoside VIII directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trigoneoside VIII?
Yes, KEHONG BIO provides custom synthesis services for Trigoneoside VIII and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.