Phomopsolide B
TL;DR: Phomopsolide B (CAS 97529-84-5) is a chemical compound with molecular formula C15H20O6 and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S)-2-[(E,3S,4S)-3,4-dihydroxypent-1-enyl]-6-oxo-2,3-dihydropyran-3-yl] (E)-2-methylbut-2-enoate
Also Known As: Phomopsolide B, Phomopsolid B, (+)-Phomopsolide B, MEGxm0_000024, ACon0_000031
| Molecular Formula | C15H20O6 |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 0.6439 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.12598 |
| Heavy Atoms | 21 |
| Complexity | 474.5555 |
Chemical Identifiers
| CAS Number | 97529-84-5 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@H]1C=CC(=O)O[C@H]1/C=C/[C@@H]([C@H](C)O)O |
Product Overview
Phomopsolide B (CAS 97529-84-5), with molecular formula C15H20O6 and molecular weight 296.13 g/mol. IUPAC: [(2S,3S)-2-[(E,3S,4S)-3,4-dihydroxypent-1-enyl]-6-oxo-2,3-dihydropyran-3-yl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of Phomopsolide B
Property Insights of Phomopsolide B
The XLogP value of 0.6439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phomopsolide B. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Phomopsolide B. Following Lipinski's Rule of Five, Phomopsolide B has 2 hydrogen bond donor(s) and 6 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 Phomopsolide B?
The CAS number of Phomopsolide B is 97529-84-5.
What is the molecular formula of Phomopsolide B?
The molecular formula of Phomopsolide B is C15H20O6.
What is the molecular weight of Phomopsolide B?
The molecular weight of Phomopsolide B is 296.13 g/mol.
Where can I buy Phomopsolide B?
You can request a quote for Phomopsolide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phomopsolide B?
Yes, KEHONG BIO provides custom synthesis services for Phomopsolide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.