KST-1A2883
TL;DR: KST-1A2883 (CAS 22820-34-4) is a chemical compound with molecular formula C27H39IO9 and molecular weight 634.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3S,5S,8R,9S,10R,13R,14S,17S)-3-acetyloxy-10-(acetyloxymethyl)-5,14-dihydroxy-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-iodoacetate
Also Known As: KST-1A2883, [2-[(3S,5S,8R,9S,10R,13R,14S,17S)-3-acetyloxy-10-(acetyloxymethyl)-5,14-dihydroxy-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-iodoacetate, 3-beta,5,14,19,21-Pentahydroxy-5-beta,14-beta-pregnan-20-one 3,19-diacetate 21-(iodoacetate), 5-beta,14-beta-Pregnan-20-one, 3-beta,5,14,19,21-pentahydroxy-, 3,19-diacetate 21-(iodoacetate), (3
| Molecular Formula | C27H39IO9 |
|---|---|
| Molecular Weight | 634.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 634.1639 |
| Heavy Atoms | 37 |
| Complexity | 954.0 |
Chemical Identifiers
| CAS Number | 22820-34-4 |
|---|---|
| SMILES | CC(=O)OC[C@]12CC[C@@H](C[C@]1(CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C(=O)COC(=O)CI)O)C)O)OC(=O)C |
| InChIKey | IIKJWHUZSBAFRB-QFEDGDFRSA-N |
Product Overview
KST-1A2883 (CAS 22820-34-4), with molecular formula C27H39IO9 and molecular weight 634.16 g/mol. IUPAC: [2-[(3S,5S,8R,9S,10R,13R,14S,17S)-3-acetyloxy-10-(acetyloxymethyl)-5,14-dihydroxy-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-iodoacetate.
Chemical Property Profile of KST-1A2883
Property Insights of KST-1A2883
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A2883. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A2883. Following Lipinski's Rule of Five, KST-1A2883 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A2883?
The CAS number of KST-1A2883 is 22820-34-4.
What is the molecular formula of KST-1A2883?
The molecular formula of KST-1A2883 is C27H39IO9.
What is the molecular weight of KST-1A2883?
The molecular weight of KST-1A2883 is 634.16 g/mol.
Where can I buy KST-1A2883?
You can request a quote for KST-1A2883 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2883?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2883 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.