17-Deoxy-22,25-epoxyholothurinogenin
TL;DR: 17-Deoxy-22,25-epoxyholothurinogenin (CAS 6758-71-0) is a chemical compound with molecular formula C30H44O4 and molecular weight 468.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5S,6S,9S,13S,16S)-6-(5,5-dimethyloxolan-2-yl)-16-hydroxy-2,6,13,17,17-pentamethyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(20),11-dien-8-one
Also Known As: 17-Deoxy-22,25-epoxyholothurinogenin, Holothurinogenin, 17-deoxy-22,25-epoxy-, Lanosta-7,9(11)-dien-18-oic acid, 22,25-epoxy-3,20-dihydroxy-, gamma-lactone, (3beta)-, 22,25-Epoxy-3,20-dihydroxylanosta-7,9(11)-dien-18-oic acid gamma-lactone, (3beta)-, Lanosta-7,9(11)-dien-18-oic acid, 22,25-epoxy-3beta,20-dihydroxy-, gamma-lactone, (20S)-
| Molecular Formula | C30H44O4 |
|---|---|
| Molecular Weight | 468.32 g/mol |
| LogP | 6.1258 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 468.32397 |
| Heavy Atoms | 34 |
| Complexity | 1005.2755 |
Chemical Identifiers
| CAS Number | 6758-71-0 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C(C1CC=C3C2=CC[C@@]45[C@]3(CC[C@@H]4[C@@](OC5=O)(C)C6CCC(O6)(C)C)C)(C)C)O |
Product Overview
17-Deoxy-22,25-epoxyholothurinogenin (CAS 6758-71-0), with molecular formula C30H44O4 and molecular weight 468.32 g/mol. IUPAC: (2S,5S,6S,9S,13S,16S)-6-(5,5-dimethyloxolan-2-yl)-16-hydroxy-2,6,13,17,17-pentamethyl-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(20),11-dien-8-one.
Chemical Property Profile of 17-Deoxy-22,25-epoxyholothurinogenin
Property Insights of 17-Deoxy-22,25-epoxyholothurinogenin
The XLogP value of 6.1258 indicates that 17-Deoxy-22,25-epoxyholothurinogenin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, 17-Deoxy-22,25-epoxyholothurinogenin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-Deoxy-22,25-epoxyholothurinogenin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17-Deoxy-22,25-epoxyholothurinogenin?
The CAS number of 17-Deoxy-22,25-epoxyholothurinogenin is 6758-71-0.
What is the molecular formula of 17-Deoxy-22,25-epoxyholothurinogenin?
The molecular formula of 17-Deoxy-22,25-epoxyholothurinogenin is C30H44O4.
What is the molecular weight of 17-Deoxy-22,25-epoxyholothurinogenin?
The molecular weight of 17-Deoxy-22,25-epoxyholothurinogenin is 468.32 g/mol.
Where can I buy 17-Deoxy-22,25-epoxyholothurinogenin?
You can request a quote for 17-Deoxy-22,25-epoxyholothurinogenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-Deoxy-22,25-epoxyholothurinogenin?
Yes, KEHONG BIO provides custom synthesis services for 17-Deoxy-22,25-epoxyholothurinogenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.