Terchebin
TL;DR: Terchebin (CAS 20598-45-2) is a chemical compound with molecular formula C41H30O27 and molecular weight 954.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,10R,18R,19R,21S,22S)-6,7,11,12,12-pentahydroxy-3,13,16-trioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20,23-tetraoxapentacyclo[16.3.1.18,11.04,9.010,15]tricosa-4,6,8,14-tetraen-19-yl]methyl 3,4,5-trihydroxybenzoate
Also Known As: Terchebin, beta-D-Glucopyranose, cyclic 2-7:4-5-(3,6-dihydro-2,9.10,11,11-pentahydroxy-3-oxo-2,6-methano-2H-1-benzoxocin-5,7-dicarboxylate) 1,3,6-tris(3,4,5-trihydroxybenzoate), (2(2S))-, ((1R,10R,18R,19R,21S,22S)-6,7,11,12,12-pentahydroxy-3,13,16-trioxo-21,22-bis((3,4,5-trihydroxybenzoyl)oxy)-2,17,20,23-tetraoxapentacyclo(16.3.1.18,11.04,9.010,15)tricosa-4,6,8,14-tetraen-19-yl)methyl 3,4,5-trihydroxybenzoate, [(1R,10R,18R,19R,21S,22S)-6,7,11,12,12-pentahydroxy-3,13,16-trioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20,23-tetraoxapentacyclo[16.3.1.18,11.04,9.010,15]tricosa-4,6,8,14-tetraen-19-yl]methyl 3,4,5-trihydroxybenzoate
| Molecular Formula | C41H30O27 |
|---|---|
| Molecular Weight | 954.10 g/mol |
| LogP | -1.0819 |
| Topological Polar Surface Area | 450.25 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 7 |
| Exact Mass | 954.0975 |
| Heavy Atoms | 68 |
| Complexity | 2866.8484 |
Chemical Identifiers
| CAS Number | 20598-45-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@@H]2[C@@H]3[C@@H]([C@H]([C@@H](O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5[C@@H]7C(=CC(=O)C(C7(O6)O)(O)O)C(=O)O3)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O |
Product Overview
Terchebin (CAS 20598-45-2), with molecular formula C41H30O27 and molecular weight 954.10 g/mol. IUPAC: [(1R,10R,18R,19R,21S,22S)-6,7,11,12,12-pentahydroxy-3,13,16-trioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20,23-tetraoxapentacyclo[16.3.1.18,11.04,9.010,15]tricosa-4,6,8,14-tetraen-19-yl]methyl 3,4,5-trihydroxybenzoate.
Chemical Property Profile of Terchebin
Property Insights of Terchebin
The XLogP value of -1.0819 indicates that Terchebin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 450.25 Ų indicates high polarity, suggesting Terchebin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Terchebin has 14 hydrogen bond donor(s) and 27 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Terchebin?
The CAS number of Terchebin is 20598-45-2.
What is the molecular formula of Terchebin?
The molecular formula of Terchebin is C41H30O27.
What is the molecular weight of Terchebin?
The molecular weight of Terchebin is 954.10 g/mol.
Where can I buy Terchebin?
You can request a quote for Terchebin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Terchebin?
Yes, KEHONG BIO provides custom synthesis services for Terchebin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.