Saponaceolide B
TL;DR: Saponaceolide B (CAS 123746-67-8) is a chemical compound with molecular formula C30H46O6 and molecular weight 502.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[2-[(3R)-3-[2-[(1S,3'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,6'-oxane]-3'-yl]ethyl]-2,2-dimethyl-6-methylidenecyclohexyl]ethylidene]oxolan-2-one
Also Known As: Saponaceolide B, (3Z)-3-[2-[(3R)-3-[2-[(1S,3'S,4S)-1-Hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,6'-oxane]-3'-yl]ethyl]-2,2-dimethyl-6-methylidenecyclohexyl]ethylidene]oxolan-2-one, 2(3H)-Furanone, 3-(2-(2,2-dimethyl-6-methylene-3-(2-(tetrahydro-1-hydroxy-4,6,6-trimethylspiro(2,5-dioxabicyclo(2.2.2)octane-3,2'-(2H)pyran)-5'-yl)ethyl)cyclohexyl)ethylidene)dihydro-, (1S-(1alpha,3beta(R*(1R*(E),3S*)),4beta))-
| Molecular Formula | C30H46O6 |
|---|---|
| Molecular Weight | 502.33 g/mol |
| LogP | 5.828 |
| Topological Polar Surface Area | 74.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.32944 |
| Heavy Atoms | 36 |
| Complexity | 925.72363 |
Chemical Identifiers
| CAS Number | 123746-67-8 |
|---|---|
| SMILES | C[C@@]12CC[C@@](C(O1)(C)C)(OC23CC[C@@H](CO3)CC[C@@H]4CCC(=C)C(C4(C)C)C/C=C\5/CCOC5=O)O |
Product Overview
Saponaceolide B (CAS 123746-67-8), with molecular formula C30H46O6 and molecular weight 502.33 g/mol. IUPAC: (3Z)-3-[2-[(3R)-3-[2-[(1S,3'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,6'-oxane]-3'-yl]ethyl]-2,2-dimethyl-6-methylidenecyclohexyl]ethylidene]oxolan-2-one.
Chemical Property Profile of Saponaceolide B
Property Insights of Saponaceolide B
The XLogP value of 5.828 indicates that Saponaceolide B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Saponaceolide B. Following Lipinski's Rule of Five, Saponaceolide B has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Saponaceolide B?
The CAS number of Saponaceolide B is 123746-67-8.
What is the molecular formula of Saponaceolide B?
The molecular formula of Saponaceolide B is C30H46O6.
What is the molecular weight of Saponaceolide B?
The molecular weight of Saponaceolide B is 502.33 g/mol.
Where can I buy Saponaceolide B?
You can request a quote for Saponaceolide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Saponaceolide B?
Yes, KEHONG BIO provides custom synthesis services for Saponaceolide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.