Spirost-5-en-1,3-diyl diacetate
TL;DR: Spirost-5-en-1,3-diyl diacetate (CAS 6155-50-6) is a chemical compound with molecular formula C31H46O6 and molecular weight 514.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,4S,7S,8R,9S,12S,13R,14R,16R)-14-acetyloxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl] acetate
Also Known As: Spirost-5-en-1,3-diyl diacetate, (22xi)-1beta,3beta-Spirost-5-en-1,3-diyl diacetate, Spirost-5-ene-1,3-diol, diacetate, (1beta,3beta,25R)-
| Molecular Formula | C31H46O6 |
|---|---|
| Molecular Weight | 514.33 g/mol |
| LogP | 5.8263 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 514.32947 |
| Heavy Atoms | 37 |
| Complexity | 980.1827 |
Chemical Identifiers
| CAS Number | 6155-50-6 |
|---|---|
| SMILES | C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4([C@@H](C[C@@H](C5)OC(=O)C)OC(=O)C)C)C)OC16CCC(CO6)C |
Product Overview
Spirost-5-en-1,3-diyl diacetate (CAS 6155-50-6), with molecular formula C31H46O6 and molecular weight 514.33 g/mol. IUPAC: [(1S,2S,4S,7S,8R,9S,12S,13R,14R,16R)-14-acetyloxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl] acetate.
Chemical Property Profile of Spirost-5-en-1,3-diyl diacetate
Property Insights of Spirost-5-en-1,3-diyl diacetate
The XLogP value of 5.8263 indicates that Spirost-5-en-1,3-diyl diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Spirost-5-en-1,3-diyl diacetate. Following Lipinski's Rule of Five, Spirost-5-en-1,3-diyl diacetate has 0 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 Spirost-5-en-1,3-diyl diacetate?
The CAS number of Spirost-5-en-1,3-diyl diacetate is 6155-50-6.
What is the molecular formula of Spirost-5-en-1,3-diyl diacetate?
The molecular formula of Spirost-5-en-1,3-diyl diacetate is C31H46O6.
What is the molecular weight of Spirost-5-en-1,3-diyl diacetate?
The molecular weight of Spirost-5-en-1,3-diyl diacetate is 514.33 g/mol.
Where can I buy Spirost-5-en-1,3-diyl diacetate?
You can request a quote for Spirost-5-en-1,3-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spirost-5-en-1,3-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for Spirost-5-en-1,3-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.