1-O-(indol-3-ylacetyl)-beta-D-glucose
TL;DR: 1-O-(indol-3-ylacetyl)-beta-D-glucose (CAS 19817-95-9) is a chemical compound with molecular formula C16H19NO7 and molecular weight 337.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-(1H-indol-3-yl)acetate
Also Known As: Iaa-glucose, 1-O-Indol-3-ylacetylglucose, 1-O-Indol-3-ylacetyl-beta-D-glucose, Indole-3-acetylglucose, Indole-3-acetyl beta-D-Glucopyranose
| Molecular Formula | C16H19NO7 |
|---|---|
| Molecular Weight | 337.12 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.11615 |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 19817-95-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| InChIKey | HHDMMUWDSFASNB-JZYAIQKZSA-N |
Product Overview
1-O-(indol-3-ylacetyl)-beta-D-glucose (CAS 19817-95-9), with molecular formula C16H19NO7 and molecular weight 337.12 g/mol. IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-(1H-indol-3-yl)acetate.
Chemical Property Profile of 1-O-(indol-3-ylacetyl)-beta-D-glucose
Property Insights of 1-O-(indol-3-ylacetyl)-beta-D-glucose
The XLogP value of -0.3 indicates that 1-O-(indol-3-ylacetyl)-beta-D-glucose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-(indol-3-ylacetyl)-beta-D-glucose. Following Lipinski's Rule of Five, 1-O-(indol-3-ylacetyl)-beta-D-glucose has 5 hydrogen bond donor(s) and 7 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 1-O-(indol-3-ylacetyl)-beta-D-glucose?
The CAS number of 1-O-(indol-3-ylacetyl)-beta-D-glucose is 19817-95-9.
What is the molecular formula of 1-O-(indol-3-ylacetyl)-beta-D-glucose?
The molecular formula of 1-O-(indol-3-ylacetyl)-beta-D-glucose is C16H19NO7.
What is the molecular weight of 1-O-(indol-3-ylacetyl)-beta-D-glucose?
The molecular weight of 1-O-(indol-3-ylacetyl)-beta-D-glucose is 337.12 g/mol.
Where can I buy 1-O-(indol-3-ylacetyl)-beta-D-glucose?
You can request a quote for 1-O-(indol-3-ylacetyl)-beta-D-glucose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-O-(indol-3-ylacetyl)-beta-D-glucose?
Yes, KEHONG BIO provides custom synthesis services for 1-O-(indol-3-ylacetyl)-beta-D-glucose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.