Dihydroepineoergosterol acetate
TL;DR: Dihydroepineoergosterol acetate (CAS 150747-52-7) is a chemical compound with molecular formula C29H44O2 and molecular weight 424.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,13R,14R,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-13-methyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: Ass 51, Dihydroepineoergosterol acetate, Dihydroneoergosterol acetate, KST-1A1578, 19-nor-ergostatrien-(5.7.9)-yl-(3Beta)-acetate
| Molecular Formula | C29H44O2 |
|---|---|
| Molecular Weight | 424.33 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.33414 |
| Heavy Atoms | 31 |
| Complexity | 626.0 |
Chemical Identifiers
| CAS Number | 150747-52-7 |
|---|---|
| SMILES | C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CCC3=C2C=CC4=C3CC[C@@H](C4)OC(=O)C)C |
| InChIKey | KREGYMYHIDTTHK-CGSRURIWSA-N |
Product Overview
Dihydroepineoergosterol acetate (CAS 150747-52-7), with molecular formula C29H44O2 and molecular weight 424.33 g/mol. IUPAC: [(3S,13R,14R,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-13-methyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of Dihydroepineoergosterol acetate
Property Insights of Dihydroepineoergosterol acetate
The XLogP value of 8.9 indicates that Dihydroepineoergosterol acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Dihydroepineoergosterol acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroepineoergosterol acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydroepineoergosterol acetate?
The CAS number of Dihydroepineoergosterol acetate is 150747-52-7.
What is the molecular formula of Dihydroepineoergosterol acetate?
The molecular formula of Dihydroepineoergosterol acetate is C29H44O2.
What is the molecular weight of Dihydroepineoergosterol acetate?
The molecular weight of Dihydroepineoergosterol acetate is 424.33 g/mol.
Where can I buy Dihydroepineoergosterol acetate?
You can request a quote for Dihydroepineoergosterol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroepineoergosterol acetate?
Yes, KEHONG BIO provides custom synthesis services for Dihydroepineoergosterol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.