7-β-半乳糖氧基香豆素-4-乙酸
TL;DR: 7-β-半乳糖氧基香豆素-4-乙酸 (CAS 127615-74-1) is a chemical compound with molecular formula C17H18O10 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-β-半乳糖氧基香豆素-4-乙酸
2-[2-oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-yl]acetic acid
Also Known As: GPOCA, 7-beta-Galactopyranosyloxycoumarin-4-acetic acid, 3-methacryloxypropylpentamethyldisiloxane, 7-O-beta-D-Galactopyranosylcoumarin-4-acetic acid, J1.666.480D
| Molecular Formula | C17H18O10 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.09 |
| Heavy Atoms | 27 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 127615-74-1 |
|---|---|
| SMILES | C1=CC2=C(C=C1O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)OC(=O)C=C2CC(=O)O |
| InChIKey | QFIOCPUZLBGHSQ-RDZAWVCESA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-β-半乳糖氧基香豆素-4-乙酸 (CAS 127615-74-1), with molecular formula C17H18O10 and molecular weight 382.09 g/mol. IUPAC: 2-[2-oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-yl]acetic acid.
Chemical Property Profile of 7-β-半乳糖氧基香豆素-4-乙酸
Property Insights of 7-β-半乳糖氧基香豆素-4-乙酸
The XLogP value of -1.7 indicates that 7-β-半乳糖氧基香豆素-4-乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.0 Ų indicates high polarity, suggesting 7-β-半乳糖氧基香豆素-4-乙酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-β-半乳糖氧基香豆素-4-乙酸 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-β-半乳糖氧基香豆素-4-乙酸?
The CAS number of 7-β-半乳糖氧基香豆素-4-乙酸 is 127615-74-1.
What is the molecular formula of 7-β-半乳糖氧基香豆素-4-乙酸?
The molecular formula of 7-β-半乳糖氧基香豆素-4-乙酸 is C17H18O10.
What is the molecular weight of 7-β-半乳糖氧基香豆素-4-乙酸?
The molecular weight of 7-β-半乳糖氧基香豆素-4-乙酸 is 382.09 g/mol.
Where can I buy 7-β-半乳糖氧基香豆素-4-乙酸?
You can request a quote for 7-β-半乳糖氧基香豆素-4-乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-β-半乳糖氧基香豆素-4-乙酸?
Yes, KEHONG BIO provides custom synthesis services for 7-β-半乳糖氧基香豆素-4-乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.