Passicapsin
TL;DR: Passicapsin (CAS 87910-72-3) is a chemical compound with molecular formula C18H27NO10 and molecular weight 417.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4S)-4-[(2S,4S,5R,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
Also Known As: Passicapsin, KST-1A8683, (1s,4s)-4-[(2,6-dideoxy-, A-d-xylo-hexopyranosyl)oxy]-1-(, A-d-glucopyranosyloxy)cyclopent-2-ene-1-carbonitrile
| Molecular Formula | C18H27NO10 |
|---|---|
| Molecular Weight | 417.16 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.16348 |
| Heavy Atoms | 29 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 87910-72-3 |
|---|---|
| SMILES | C[C@@H]1[C@@H]([C@H](C[C@H](O1)O[C@H]2C[C@](C=C2)(C#N)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O |
| InChIKey | KQTRNMODDGXNSU-OASXGSIPSA-N |
Product Overview
Passicapsin (CAS 87910-72-3), with molecular formula C18H27NO10 and molecular weight 417.16 g/mol. IUPAC: (1S,4S)-4-[(2S,4S,5R,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile.
Chemical Property Profile of Passicapsin
Property Insights of Passicapsin
The XLogP value of -2.4 indicates that Passicapsin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 182.0 Ų indicates high polarity, suggesting Passicapsin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Passicapsin has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Passicapsin?
The CAS number of Passicapsin is 87910-72-3.
What is the molecular formula of Passicapsin?
The molecular formula of Passicapsin is C18H27NO10.
What is the molecular weight of Passicapsin?
The molecular weight of Passicapsin is 417.16 g/mol.
Where can I buy Passicapsin?
You can request a quote for Passicapsin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Passicapsin?
Yes, KEHONG BIO provides custom synthesis services for Passicapsin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.