黄鼠李苷
TL;DR: 黄鼠李苷 (CAS 71241-97-9) is a chemical compound with molecular formula C34H42O20 and molecular weight 770.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
黄鼠李苷
3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Also Known As: Xanthorhamnin, Xanthorhamnin B, Compound NP-000535, MEGxp0_000215, ACon1_002043
| Molecular Formula | C34H42O20 |
|---|---|
| Molecular Weight | 770.23 g/mol |
| LogP | -2.5323 |
| Topological Polar Surface Area | 317.35 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 9 |
| Exact Mass | 770.2269 |
| Heavy Atoms | 54 |
| Complexity | 1852.0188 |
Chemical Identifiers
| CAS Number | 71241-97-9 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@H]([C@@H]2O)OC[C@@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)OC4=C(OC5=CC(=CC(=C5C4=O)O)OC)C6=CC(=C(C=C6)O)O)O)O)O)C)O)O)O)O |
Product Overview
黄鼠李苷 (CAS 71241-97-9), with molecular formula C34H42O20 and molecular weight 770.23 g/mol. IUPAC: 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one.
Chemical Property Profile of 黄鼠李苷
Property Insights of 黄鼠李苷
The XLogP value of -2.5323 indicates that 黄鼠李苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 317.35 Ų indicates high polarity, suggesting 黄鼠李苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 黄鼠李苷 has 11 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 黄鼠李苷?
The CAS number of 黄鼠李苷 is 71241-97-9.
What is the molecular formula of 黄鼠李苷?
The molecular formula of 黄鼠李苷 is C34H42O20.
What is the molecular weight of 黄鼠李苷?
The molecular weight of 黄鼠李苷 is 770.23 g/mol.
Where can I buy 黄鼠李苷?
You can request a quote for 黄鼠李苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 黄鼠李苷?
Yes, KEHONG BIO provides custom synthesis services for 黄鼠李苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.