4-cholesten-3-(O-carboxymethyl)oxime
TL;DR: 4-cholesten-3-(O-carboxymethyl)oxime (CAS 73489-89-1) is a chemical compound with molecular formula C29H47NO3 and molecular weight 457.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]oxyacetic acid
Also Known As: 4-Cholesten-3-(O-carboxymethyl)oxime, Acetic acid, ((cholest-4-en-3-ylideneamino)oxy)-, 2-[(Z)-[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]oxyacetic acid, RefChem:98628
| Molecular Formula | C29H47NO3 |
|---|---|
| Molecular Weight | 457.36 g/mol |
| LogP | 7.485 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 457.3556 |
| Heavy Atoms | 33 |
| Complexity | 785.7365 |
Chemical Identifiers
| CAS Number | 73489-89-1 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2CCC4=C/C(=N\OCC(=O)O)/CC[C@]34C)C |
Product Overview
4-cholesten-3-(O-carboxymethyl)oxime (CAS 73489-89-1), with molecular formula C29H47NO3 and molecular weight 457.36 g/mol. IUPAC: 2-[(Z)-[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]oxyacetic acid.
Chemical Property Profile of 4-cholesten-3-(O-carboxymethyl)oxime
Property Insights of 4-cholesten-3-(O-carboxymethyl)oxime
The XLogP value of 7.485 indicates that 4-cholesten-3-(O-carboxymethyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.89 Ų, 4-cholesten-3-(O-carboxymethyl)oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-cholesten-3-(O-carboxymethyl)oxime has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-cholesten-3-(O-carboxymethyl)oxime?
The CAS number of 4-cholesten-3-(O-carboxymethyl)oxime is 73489-89-1.
What is the molecular formula of 4-cholesten-3-(O-carboxymethyl)oxime?
The molecular formula of 4-cholesten-3-(O-carboxymethyl)oxime is C29H47NO3.
What is the molecular weight of 4-cholesten-3-(O-carboxymethyl)oxime?
The molecular weight of 4-cholesten-3-(O-carboxymethyl)oxime is 457.36 g/mol.
Where can I buy 4-cholesten-3-(O-carboxymethyl)oxime?
You can request a quote for 4-cholesten-3-(O-carboxymethyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-cholesten-3-(O-carboxymethyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 4-cholesten-3-(O-carboxymethyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.