7-Deacetylkhivorin
TL;DR: 7-Deacetylkhivorin (CAS 23577-64-2) is a chemical compound with molecular formula C30H40O9 and molecular weight 544.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,4S,7S,8S,12S,13S,15R,19R)-13-acetyloxy-7-(furan-3-yl)-19-hydroxy-1,8,12,16,16-pentamethyl-5-oxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadecan-15-yl] acetate
Also Known As: 7-DEACETYLKHIVORIN, Spectrum2_000231, Spectrum3_000009, Spectrum4_001290, Spectrum5_000019
| Molecular Formula | C30H40O9 |
|---|---|
| Molecular Weight | 544.27 g/mol |
| LogP | 4.1181 |
| Topological Polar Surface Area | 124.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 544.2672 |
| Heavy Atoms | 39 |
| Complexity | 1206.9105 |
Chemical Identifiers
| CAS Number | 23577-64-2 |
|---|---|
| SMILES | CC(=O)O[C@H]1C[C@H](C(C2[C@]1(C3CC[C@]4([C@@H](OC(=O)[C@@H]5[C@@]4([C@@]3([C@@H](C2)O)C)O5)C6=COC=C6)C)C)(C)C)OC(=O)C |
Product Overview
7-Deacetylkhivorin (CAS 23577-64-2), with molecular formula C30H40O9 and molecular weight 544.27 g/mol. IUPAC: [(1S,2R,4S,7S,8S,12S,13S,15R,19R)-13-acetyloxy-7-(furan-3-yl)-19-hydroxy-1,8,12,16,16-pentamethyl-5-oxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadecan-15-yl] acetate.
Chemical Property Profile of 7-Deacetylkhivorin
Property Insights of 7-Deacetylkhivorin
The XLogP value of 4.1181 indicates that 7-Deacetylkhivorin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Deacetylkhivorin. Following Lipinski's Rule of Five, 7-Deacetylkhivorin has 1 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 7-Deacetylkhivorin?
The CAS number of 7-Deacetylkhivorin is 23577-64-2.
What is the molecular formula of 7-Deacetylkhivorin?
The molecular formula of 7-Deacetylkhivorin is C30H40O9.
What is the molecular weight of 7-Deacetylkhivorin?
The molecular weight of 7-Deacetylkhivorin is 544.27 g/mol.
Where can I buy 7-Deacetylkhivorin?
You can request a quote for 7-Deacetylkhivorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Deacetylkhivorin?
Yes, KEHONG BIO provides custom synthesis services for 7-Deacetylkhivorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.