Procyanidin B3
TL;DR: Procyanidin B3 (CAS 23567-23-9) is a chemical compound with molecular formula C30H26O12 and molecular weight 578.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Also Known As: Procyanidin B3, Proanthocyanidin B3, Procyanidin B-3, Procyanidin B2, proanthocyanidin B-3
| Molecular Formula | C30H26O12 |
|---|---|
| Molecular Weight | 578.14 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 3 |
| Exact Mass | 578.14246 |
| Heavy Atoms | 42 |
| Complexity | 925.0 |
Chemical Identifiers
| CAS Number | 23567-23-9 |
|---|---|
| SMILES | C1[C@@H]([C@H](OC2=C1C(=CC(=C2[C@H]3[C@@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O |
| InChIKey | XFZJEEAOWLFHDH-AVFWISQGSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Procyanidin B3 (CAS 23567-23-9), with molecular formula C30H26O12 and molecular weight 578.14 g/mol. IUPAC: (2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol.
Chemical Property Profile of Procyanidin B3
Property Insights of Procyanidin B3
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Procyanidin B3. The TPSA of 221.0 Ų indicates high polarity, suggesting Procyanidin B3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Procyanidin B3 has 10 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Procyanidin B3?
The CAS number of Procyanidin B3 is 23567-23-9.
What is the molecular formula of Procyanidin B3?
The molecular formula of Procyanidin B3 is C30H26O12.
What is the molecular weight of Procyanidin B3?
The molecular weight of Procyanidin B3 is 578.14 g/mol.
Where can I buy Procyanidin B3?
You can request a quote for Procyanidin B3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Procyanidin B3?
Yes, KEHONG BIO provides custom synthesis services for Procyanidin B3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.