N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine
TL;DR: N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine (CAS 17598-73-1) is a chemical compound with molecular formula C18H24N2O7 and molecular weight 380.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Dmguht, Bufotenine glucuronide, N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine, 3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl beta-D-glucopyranosiduronic acid, (2S,3S,4S,5R,6S)-6-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C18H24N2O7 |
|---|---|
| Molecular Weight | 380.16 g/mol |
| LogP | -0.457 |
| Topological Polar Surface Area | 135.48 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.15836 |
| Heavy Atoms | 27 |
| Complexity | 806.10406 |
Chemical Identifiers
| CAS Number | 17598-73-1 |
|---|---|
| SMILES | CN(C)CCC1=CNC2=C1C=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
Product Overview
N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine (CAS 17598-73-1), with molecular formula C18H24N2O7 and molecular weight 380.16 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine
Property Insights of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine
The XLogP value of -0.457 indicates that N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine. Following Lipinski's Rule of Five, N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine 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 N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine?
The CAS number of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine is 17598-73-1.
What is the molecular formula of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine?
The molecular formula of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine is C18H24N2O7.
What is the molecular weight of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine?
The molecular weight of N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine is 380.16 g/mol.
Where can I buy N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine?
You can request a quote for N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-O-glucopyranuronosyl-5-hydroxytryptamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.