Oxydifficidin
TL;DR: Oxydifficidin (CAS 95152-89-9) is a chemical compound with molecular formula C31H45O7P and molecular weight 560.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[18-hydroxy-7,19-dimethyl-2-(3-methylhexa-3,5-dienyl)-20-methylidene-22-oxo-1-oxacyclodocosa-4,6,12,14,16-pentaen-8-yl] dihydrogen phosphate
Also Known As: Oxydifficidin, (18-hydroxy-7,19-dimethyl-2-(3-methylhexa-3,5-dienyl)-20-methylidene-22-oxo-1-oxacyclodocosa-4,6,12,14,16-pentaen-8-yl) dihydrogen phosphate, [18-hydroxy-7,19-dimethyl-2-(3-methylhexa-3,5-dienyl)-20-methylidene-22-oxo-1-oxacyclodocosa-4,6,12,14,16-pentaen-8-yl] dihydrogen phosphate, 18-Hydroxy-7,19-dimethyl-20-methylene-2-(3-methylhexa-3,5-dien-1-yl)-22-oxooxacyclodocosa-4,6,12,14,16-pentaen-8-yl dihydrogen phosphate, Oxacyclodocosa-7,9,11,17,19-pentaen-2-one, 6-hydroxy-5,17-dimethyl-4-methylene-22-(3-methyl-3,5-hexadienyl)-16-(phosphonooxy)-
| Molecular Formula | C31H45O7P |
|---|---|
| Molecular Weight | 560.29 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 560.2903 |
| Heavy Atoms | 39 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 95152-89-9 |
|---|---|
| SMILES | CC1C(C=CC=CC=CCCCC(C(=CC=CCC(OC(=O)CC1=C)CCC(=CC=C)C)C)OP(=O)(O)O)O |
| InChIKey | DRXGPYFQEKBQBQ-UHFFFAOYSA-N |
Product Overview
Oxydifficidin (CAS 95152-89-9), with molecular formula C31H45O7P and molecular weight 560.29 g/mol. IUPAC: [18-hydroxy-7,19-dimethyl-2-(3-methylhexa-3,5-dienyl)-20-methylidene-22-oxo-1-oxacyclodocosa-4,6,12,14,16-pentaen-8-yl] dihydrogen phosphate.
Chemical Property Profile of Oxydifficidin
Property Insights of Oxydifficidin
The XLogP value of 6.1 indicates that Oxydifficidin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxydifficidin. Following Lipinski's Rule of Five, Oxydifficidin has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Oxydifficidin?
The CAS number of Oxydifficidin is 95152-89-9.
What is the molecular formula of Oxydifficidin?
The molecular formula of Oxydifficidin is C31H45O7P.
What is the molecular weight of Oxydifficidin?
The molecular weight of Oxydifficidin is 560.29 g/mol.
Where can I buy Oxydifficidin?
You can request a quote for Oxydifficidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxydifficidin?
Yes, KEHONG BIO provides custom synthesis services for Oxydifficidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.