Integracin A
TL;DR: Integracin A (CAS 224186-03-2) is a chemical compound with molecular formula C37H56O8 and molecular weight 628.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(3,5-dihydroxyphenyl)undecan-4-yl 2-(8-acetyloxyundecyl)-4,6-dihydroxybenzoate
Also Known As: Integracin A, 11-(3,5-dihydroxyphenyl)undecan-4-yl 2-(8-acetyloxyundecyl)-4,6-dihydroxybenzoate, J1.691.045G, Benzoic acid, 2-[8-(acetyloxy)undecyl]-4,6-dihydroxy-, 8-(3,5-dihydroxyphenyl)-1-propyloctyl ester, [8-(3,5-dihydroxyphenyl)-1-propyl-octyl] 2-(8-acetoxyundecyl)-4,6-dihydroxy-benzoate
| Molecular Formula | C37H56O8 |
|---|---|
| Molecular Weight | 628.40 g/mol |
| LogP | 11.4 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Exact Mass | 628.3975 |
| Heavy Atoms | 45 |
| Complexity | 780.0 |
Chemical Identifiers
| CAS Number | 224186-03-2 |
|---|---|
| SMILES | CCCC(CCCCCCCC1=C(C(=CC(=C1)O)O)C(=O)OC(CCC)CCCCCCCC2=CC(=CC(=C2)O)O)OC(=O)C |
| InChIKey | LCCCZIASPPCLCU-UHFFFAOYSA-N |
Product Overview
Integracin A (CAS 224186-03-2), with molecular formula C37H56O8 and molecular weight 628.40 g/mol. IUPAC: 11-(3,5-dihydroxyphenyl)undecan-4-yl 2-(8-acetyloxyundecyl)-4,6-dihydroxybenzoate.
Chemical Property Profile of Integracin A
Property Insights of Integracin A
The XLogP value of 11.4 indicates that Integracin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Integracin A. Following Lipinski's Rule of Five, Integracin A has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Integracin A?
The CAS number of Integracin A is 224186-03-2.
What is the molecular formula of Integracin A?
The molecular formula of Integracin A is C37H56O8.
What is the molecular weight of Integracin A?
The molecular weight of Integracin A is 628.40 g/mol.
Where can I buy Integracin A?
You can request a quote for Integracin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Integracin A?
Yes, KEHONG BIO provides custom synthesis services for Integracin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.