7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside
TL;DR: 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside (CAS 95061-84-0) is a chemical compound with molecular formula C16H19NO9 and molecular weight 369.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3-dihydroindol-3-yl]acetic acid
Also Known As: 7-OH-Oxiaa-glc, 7-Hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside, 2-[2-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3-dihydroindol-3-yl]acetic acid, [5-(Hexopyranosyloxy)-2-hydroxy-3H-indol-3-yl]acetic acid, [5-(beta-D-Glucopyranosyloxy)-2-hydroxy-3H-indol-3-yl]acetic acid
| Molecular Formula | C16H19NO9 |
|---|---|
| Molecular Weight | 369.11 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.106 |
| Heavy Atoms | 26 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 95061-84-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(C(=O)N2)CC(=O)O |
| InChIKey | RYVAMWUBEGALRT-HQXNCQBTSA-N |
Product Overview
7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside (CAS 95061-84-0), with molecular formula C16H19NO9 and molecular weight 369.11 g/mol. IUPAC: 2-[2-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3-dihydroindol-3-yl]acetic acid.
Chemical Property Profile of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside
Property Insights of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside
The XLogP value of -1.9 indicates that 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 166.0 Ų indicates high polarity, suggesting 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside?
The CAS number of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside is 95061-84-0.
What is the molecular formula of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside?
The molecular formula of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside is C16H19NO9.
What is the molecular weight of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside?
The molecular weight of 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside is 369.11 g/mol.
Where can I buy 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside?
You can request a quote for 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 7-hydroxy-2-oxoindole-3-acetic acid 7'-O-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.