Dendrogenin A
TL;DR: Dendrogenin A (CAS 1191043-85-2) is a chemical compound with molecular formula C32H55N3O2 and molecular weight 513.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5R,6R,8S,9S,10R,13R,14S,17R)-6-[2-(1H-imidazol-5-yl)ethylamino]-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5-diol
Also Known As: DENDROGENIN A, 5alpha-hydroxy-6beta-[2-(1H-imidazol-4-yl)-ethylamino]-cholestan-3beta-ol, 5alpha-hydroxy-6beta-(2-(1H-imidazol-4-yl)-ethylamino)-cholestan-3beta-ol, 5alpha-Hydroxy-6beta-[2-(1H-imidazol-4-yl)ethylamino]cholestan-3beta-ol, (3S,5R,6R,8S,9S,10R,13R,14S,17R)-6-[2-(1H-imidazol-5-yl)ethylamino]-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5-diol
| Molecular Formula | C32H55N3O2 |
|---|---|
| Molecular Weight | 513.43 g/mol |
| LogP | 6.1174 |
| Topological Polar Surface Area | 81.17 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 513.42944 |
| Heavy Atoms | 37 |
| Complexity | 888.6042 |
Chemical Identifiers
| CAS Number | 1191043-85-2 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)O)C)O)NCCC5=CN=CN5)C |
Product Overview
Dendrogenin A (CAS 1191043-85-2), with molecular formula C32H55N3O2 and molecular weight 513.43 g/mol. IUPAC: (3S,5R,6R,8S,9S,10R,13R,14S,17R)-6-[2-(1H-imidazol-5-yl)ethylamino]-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5-diol.
Chemical Property Profile of Dendrogenin A
Property Insights of Dendrogenin A
The XLogP value of 6.1174 indicates that Dendrogenin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Dendrogenin A. Following Lipinski's Rule of Five, Dendrogenin A has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dendrogenin A?
The CAS number of Dendrogenin A is 1191043-85-2.
What is the molecular formula of Dendrogenin A?
The molecular formula of Dendrogenin A is C32H55N3O2.
What is the molecular weight of Dendrogenin A?
The molecular weight of Dendrogenin A is 513.43 g/mol.
Where can I buy Dendrogenin A?
You can request a quote for Dendrogenin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dendrogenin A?
Yes, KEHONG BIO provides custom synthesis services for Dendrogenin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.