大饰缘花苷 II
TL;DR: 大饰缘花苷 II (CAS 1268481-34-0) is a chemical compound with molecular formula C41H30O26 and molecular weight 938.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
大饰缘花苷 II
[(10R,11S,12R,13S,15R)-3,4,5,21,22,23-hexahydroxy-8,18-dioxo-12,13-bis[(3,4,5-trihydroxybenzoyl)oxy]-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-11-yl] 3,4,5-trihydroxybenzoate
Also Known As: Eugeniin, Tellimagrandin II, Cornustannin 2, Tellimagrandin 2, MEGxp0_001162
| Molecular Formula | C41H30O26 |
|---|---|
| Molecular Weight | 938.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 444.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 26 |
| Rotatable Bonds | 9 |
| Exact Mass | 938.10254 |
| Heavy Atoms | 67 |
| Complexity | 1770.0 |
Chemical Identifiers
| CAS Number | 1268481-34-0 |
|---|---|
| SMILES | C1[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O1)O)O)O)O)O)O |
| InChIKey | JCGHAEBIBSEQAD-UUUCSUBKSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
大饰缘花苷 II (CAS 1268481-34-0), with molecular formula C41H30O26 and molecular weight 938.10 g/mol. IUPAC: [(10R,11S,12R,13S,15R)-3,4,5,21,22,23-hexahydroxy-8,18-dioxo-12,13-bis[(3,4,5-trihydroxybenzoyl)oxy]-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-11-yl] 3,4,5-trihydroxybenzoate.
Chemical Property Profile of 大饰缘花苷 II
Property Insights of 大饰缘花苷 II
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 大饰缘花苷 II. The TPSA of 444.0 Ų indicates high polarity, suggesting 大饰缘花苷 II may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 大饰缘花苷 II has 15 hydrogen bond donor(s) and 26 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 大饰缘花苷 II?
The CAS number of 大饰缘花苷 II is 1268481-34-0.
What is the molecular formula of 大饰缘花苷 II?
The molecular formula of 大饰缘花苷 II is C41H30O26.
What is the molecular weight of 大饰缘花苷 II?
The molecular weight of 大饰缘花苷 II is 938.10 g/mol.
Where can I buy 大饰缘花苷 II?
You can request a quote for 大饰缘花苷 II directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 大饰缘花苷 II?
Yes, KEHONG BIO provides custom synthesis services for 大饰缘花苷 II and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.