DESACETYLUNDULATONE
TL;DR: DESACETYLUNDULATONE (CAS 70993-79-2) is a chemical compound with molecular formula C25H32O10 and molecular weight 492.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,5R,6R,7S,8R,11S,12R,13S,17S,18S,19R)-4,5,8,17-tetrahydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-12-yl] (E)-2-methylbut-2-enoate
Also Known As: DESACETYLUNDULATONE
| Molecular Formula | C25H32O10 |
|---|---|
| Molecular Weight | 492.20 g/mol |
| LogP | -0.3751 |
| Topological Polar Surface Area | 159.82 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 492.19955 |
| Heavy Atoms | 35 |
| Complexity | 1064.4658 |
Chemical Identifiers
| CAS Number | 70993-79-2 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@@H]1[C@H]2C(=CC(=O)[C@H]([C@@]2([C@@H]3[C@@]45[C@@H]1OC(=O)[C@@H]([C@H]4[C@H]([C@H](C3(OC5)O)O)C)O)C)O)C |
Product Overview
DESACETYLUNDULATONE (CAS 70993-79-2), with molecular formula C25H32O10 and molecular weight 492.20 g/mol. IUPAC: [(1S,5R,6R,7S,8R,11S,12R,13S,17S,18S,19R)-4,5,8,17-tetrahydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-12-yl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of DESACETYLUNDULATONE
Property Insights of DESACETYLUNDULATONE
The XLogP value of -0.3751 indicates that DESACETYLUNDULATONE is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.82 Ų indicates high polarity, suggesting DESACETYLUNDULATONE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DESACETYLUNDULATONE has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DESACETYLUNDULATONE?
The CAS number of DESACETYLUNDULATONE is 70993-79-2.
What is the molecular formula of DESACETYLUNDULATONE?
The molecular formula of DESACETYLUNDULATONE is C25H32O10.
What is the molecular weight of DESACETYLUNDULATONE?
The molecular weight of DESACETYLUNDULATONE is 492.20 g/mol.
Where can I buy DESACETYLUNDULATONE?
You can request a quote for DESACETYLUNDULATONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DESACETYLUNDULATONE?
Yes, KEHONG BIO provides custom synthesis services for DESACETYLUNDULATONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.