Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin
TL;DR: Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin (CAS 103883-03-0) is a chemical compound with molecular formula C30H24O13 and molecular weight 592.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,5R,6R,13S,21R)-5-(3,4-dihydroxyphenyl)-13-(3,4,5-trihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
Also Known As: Procyanidin A1, Proanthocyanidin A1, WODBGULXKVZGQF-QCPBNORNSA-, epigallocatechin-(4beta->8,2beta->O-7)-epicatechin, J1.253.388H
| Molecular Formula | C30H24O13 |
|---|---|
| Molecular Weight | 592.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 230.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 2 |
| Exact Mass | 592.1217 |
| Heavy Atoms | 43 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 103883-03-0 |
|---|---|
| SMILES | C1[C@H]([C@H](OC2=C1C(=CC3=C2[C@@H]4[C@H]([C@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O |
| InChIKey | WODBGULXKVZGQF-QCPBNORNSA-N |
Product Overview
Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin (CAS 103883-03-0), with molecular formula C30H24O13 and molecular weight 592.12 g/mol. IUPAC: (1R,5R,6R,13S,21R)-5-(3,4-dihydroxyphenyl)-13-(3,4,5-trihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol.
Chemical Property Profile of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin
Property Insights of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin. The TPSA of 230.0 Ų indicates high polarity, suggesting Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin has 10 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin?
The CAS number of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin is 103883-03-0.
What is the molecular formula of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin?
The molecular formula of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin is C30H24O13.
What is the molecular weight of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin?
The molecular weight of Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin is 592.12 g/mol.
Where can I buy Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin?
You can request a quote for Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin?
Yes, KEHONG BIO provides custom synthesis services for Epigallocatechin-(4beta->8,2beta->O-7)-epicatechin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.