CHO006
TL;DR: CHO006 (CAS 246529-23-7) is a chemical compound with molecular formula C44H79NO5 and molecular weight 701.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-4-[(3S,7R,10S,12S,13R,17R)-7,12-dihydroxy-3-(icosanoylamino)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Also Known As: CHO006, Cholan-24-oic acid, 7,12-dihydroxy-3-[(1-oxoeicosyl)amino]-, (3, A,5, A,7, A,12
| Molecular Formula | C44H79NO5 |
|---|---|
| Molecular Weight | 701.60 g/mol |
| LogP | 10.6143 |
| Topological Polar Surface Area | 106.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 23 |
| Exact Mass | 701.5958 |
| Heavy Atoms | 50 |
| Complexity | 1018.36554 |
Chemical Identifiers
| CAS Number | 246529-23-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)N[C@H]1CC[C@]2(C(C1)C[C@H](C3C2C[C@@H]([C@]4(C3CC[C@@H]4[C@H](C)CCC(=O)O)C)O)O)C |
Product Overview
CHO006 (CAS 246529-23-7), with molecular formula C44H79NO5 and molecular weight 701.60 g/mol. IUPAC: (4R)-4-[(3S,7R,10S,12S,13R,17R)-7,12-dihydroxy-3-(icosanoylamino)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid.
Chemical Property Profile of CHO006
Property Insights of CHO006
The XLogP value of 10.6143 indicates that CHO006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.86 Ų falls within the moderate polarity range, balancing permeability and solubility for CHO006. Following Lipinski's Rule of Five, CHO006 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 CHO006?
The CAS number of CHO006 is 246529-23-7.
What is the molecular formula of CHO006?
The molecular formula of CHO006 is C44H79NO5.
What is the molecular weight of CHO006?
The molecular weight of CHO006 is 701.60 g/mol.
Where can I buy CHO006?
You can request a quote for CHO006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CHO006?
Yes, KEHONG BIO provides custom synthesis services for CHO006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.