23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin
TL;DR: 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin (CAS 142386-67-2) is a chemical compound with molecular formula C37H56O12 and molecular weight 692.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[2-hydroxy-2-[3-hydroxy-4-[(4Z,6E,12E,14E)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl]-5,6-dimethyloxan-4-yl]oxy-4-oxobut-2-enoic acid
Also Known As: PD 118576-A1, 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin, Hygrolidin, 23-deethyl-2-demethyl-2-methoxy-23-methyl-
| Molecular Formula | C37H56O12 |
|---|---|
| Molecular Weight | 692.38 g/mol |
| LogP | 4.2483 |
| Topological Polar Surface Area | 178.28 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 692.3772 |
| Heavy Atoms | 49 |
| Complexity | 1297.8346 |
Chemical Identifiers
| CAS Number | 142386-67-2 |
|---|---|
| SMILES | CC1C/C(=C/C=C\C(C(OC(=O)/C(=C\C(=C\C(C1O)C)\C)/OC)C(C)C(C(C)C2(CC(C(C(O2)C)C)OC(=O)/C=C/C(=O)O)O)O)OC)/C |
Product Overview
23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin (CAS 142386-67-2), with molecular formula C37H56O12 and molecular weight 692.38 g/mol. IUPAC: (E)-4-[2-hydroxy-2-[3-hydroxy-4-[(4Z,6E,12E,14E)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl]-5,6-dimethyloxan-4-yl]oxy-4-oxobut-2-enoic acid.
Chemical Property Profile of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin
Property Insights of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin
The XLogP value of 4.2483 indicates that 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 178.28 Ų indicates high polarity, suggesting 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin?
The CAS number of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin is 142386-67-2.
What is the molecular formula of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin?
The molecular formula of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin is C37H56O12.
What is the molecular weight of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin?
The molecular weight of 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin is 692.38 g/mol.
Where can I buy 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin?
You can request a quote for 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin?
Yes, KEHONG BIO provides custom synthesis services for 23-Deethyl-2-demethyl-2-methoxy-23-methylhygrolidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.