Α-葡萄素
TL;DR: Α-葡萄素 (CAS 62218-13-7) is a chemical compound with molecular formula C42H30O9 and molecular weight 678.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Α-葡萄素
(2R,3R,10R,11R,18S,19S)-3,11,19-tris(4-hydroxyphenyl)-4,12,20-trioxaheptacyclo[16.6.1.12,5.110,13.021,25.09,27.017,26]heptacosa-1(25),5,7,9(27),13,15,17(26),21,23-nonaene-7,15,23-triol
Also Known As: alpha-Viniferin, (+)-Alpha-Viniferin, A-Viniferin, Viniferin-alpha, -Viniferin
| Molecular Formula | C42H30O9 |
|---|---|
| Molecular Weight | 678.19 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 678.18896 |
| Heavy Atoms | 51 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 62218-13-7 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@H]2[C@@H]3C4=C5[C@@H]([C@H](OC5=CC(=C4)O)C6=CC=C(C=C6)O)C7=C8[C@H]([C@@H](OC8=CC(=C7)O)C9=CC=C(C=C9)O)C1=C3C(=CC(=C1)O)O2)O |
| InChIKey | KUTVNHOAKHJJFL-ZSIJVUTGSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Α-葡萄素 (CAS 62218-13-7), with molecular formula C42H30O9 and molecular weight 678.19 g/mol. IUPAC: (2R,3R,10R,11R,18S,19S)-3,11,19-tris(4-hydroxyphenyl)-4,12,20-trioxaheptacyclo[16.6.1.12,5.110,13.021,25.09,27.017,26]heptacosa-1(25),5,7,9(27),13,15,17(26),21,23-nonaene-7,15,23-triol.
Chemical Property Profile of Α-葡萄素
Property Insights of Α-葡萄素
The XLogP value of 6.8 indicates that Α-葡萄素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting Α-葡萄素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Α-葡萄素 has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Α-葡萄素?
The CAS number of Α-葡萄素 is 62218-13-7.
What is the molecular formula of Α-葡萄素?
The molecular formula of Α-葡萄素 is C42H30O9.
What is the molecular weight of Α-葡萄素?
The molecular weight of Α-葡萄素 is 678.19 g/mol.
Where can I buy Α-葡萄素?
You can request a quote for Α-葡萄素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Α-葡萄素?
Yes, KEHONG BIO provides custom synthesis services for Α-葡萄素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.