Pectolinarin
TL;DR: Pectolinarin (CAS 134-33-8) is a chemical compound with molecular formula C29H34O15 and molecular weight 622.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Also Known As: Pectolinarin, Pectolinaroside, Spectrum2_000210, Spectrum3_000166, Spectrum4_001489
| Molecular Formula | C29H34O15 |
|---|---|
| Molecular Weight | 622.19 g/mol |
| LogP | -0.7867 |
| Topological Polar Surface Area | 227.2 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 622.18976 |
| Heavy Atoms | 44 |
| Complexity | 1507.3748 |
Chemical Identifiers
| CAS Number | 134-33-8 |
|---|---|
| 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(C(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)OC)O)O)O)O)O)O |
Product Overview
Pectolinarin (CAS 134-33-8), with molecular formula C29H34O15 and molecular weight 622.19 g/mol. IUPAC: 5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Pectolinarin
Property Insights of Pectolinarin
The XLogP value of -0.7867 indicates that Pectolinarin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 227.2 Ų indicates high polarity, suggesting Pectolinarin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pectolinarin has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pectolinarin?
The CAS number of Pectolinarin is 134-33-8.
What is the molecular formula of Pectolinarin?
The molecular formula of Pectolinarin is C29H34O15.
What is the molecular weight of Pectolinarin?
The molecular weight of Pectolinarin is 622.19 g/mol.
Where can I buy Pectolinarin?
You can request a quote for Pectolinarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pectolinarin?
Yes, KEHONG BIO provides custom synthesis services for Pectolinarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.