Siphonarin B
TL;DR: Siphonarin B (CAS 92125-68-3) is a chemical compound with molecular formula C29H44O8 and molecular weight 520.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6S,8S,9S,11R)-2-[1-(6-ethyl-3,5-dimethyl-4-oxopyran-2-yl)ethyl]-2,4-dihydroxy-3,5,9,11-tetramethyl-8-[(2S)-3-oxopentan-2-yl]-1,7-dioxaspiro[5.5]undecan-10-one
Also Known As: Siphonarin B, Dihydrosiphonarin B, ( )-Siphonarin B, (+)-Siphonarin B, (2R,3R,4S,5S,6S,8S,9S,11R)-2-[1-(6-ethyl-3,5-dimethyl-4-oxopyran-2-yl)ethyl]-2,4-dihydroxy-3,5,9,11-tetramethyl-8-[(2S)-3-oxopentan-2-yl]-1,7-dioxaspiro[5.5]undecan-10-one
| Molecular Formula | C29H44O8 |
|---|---|
| Molecular Weight | 520.30 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.3036 |
| Heavy Atoms | 37 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 92125-68-3 |
|---|---|
| SMILES | CCC1=C(C(=O)C(=C(O1)C(C)[C@]2([C@@H]([C@@H]([C@@H]([C@]3(O2)[C@@H](C(=O)[C@H]([C@@H](O3)[C@H](C)C(=O)CC)C)C)C)O)C)O)C)C |
| InChIKey | LEPZJIOTHLJGCD-BWINTEPNSA-N |
Product Overview
Siphonarin B (CAS 92125-68-3), with molecular formula C29H44O8 and molecular weight 520.30 g/mol. IUPAC: (2R,3R,4S,5S,6S,8S,9S,11R)-2-[1-(6-ethyl-3,5-dimethyl-4-oxopyran-2-yl)ethyl]-2,4-dihydroxy-3,5,9,11-tetramethyl-8-[(2S)-3-oxopentan-2-yl]-1,7-dioxaspiro[5.5]undecan-10-one.
Chemical Property Profile of Siphonarin B
Property Insights of Siphonarin B
The XLogP value of 3.4 indicates that Siphonarin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Siphonarin B. Following Lipinski's Rule of Five, Siphonarin B has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Siphonarin B?
The CAS number of Siphonarin B is 92125-68-3.
What is the molecular formula of Siphonarin B?
The molecular formula of Siphonarin B is C29H44O8.
What is the molecular weight of Siphonarin B?
The molecular weight of Siphonarin B is 520.30 g/mol.
Where can I buy Siphonarin B?
You can request a quote for Siphonarin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Siphonarin B?
Yes, KEHONG BIO provides custom synthesis services for Siphonarin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.