Alangiside
TL;DR: Alangiside (CAS 34482-51-4) is a chemical compound with molecular formula C25H31NO10 and molecular weight 505.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,15S,16R,17S)-16-ethenyl-4-hydroxy-5-methoxy-15-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-11-one
Also Known As: Alangiside, (1R,15S,16R,17S)-16-ethenyl-4-hydroxy-5-methoxy-15-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-11-one, (11S)-12alpha-Ethenyl-11beta-(beta-D-glucopyranosyloxy)-5,11,12,12abeta,13,13abeta-hexahydro-2-hydroxy-3-methoxy-6H,8H-benzo[a]pyrano[3,4-g]quinolizin-8-one, (11S,12aR,13aR)-12-ethenyl-11-(beta-D-glucopyranosyloxy)-2-hydroxy-3-methoxy-5,6,12,12a,13,13a-hexahydro-11H-pyrano(4',3':4,5)pyrido(2,1-a)isoquinolin-8-one, (11S,12R,12aS,13aR)-12-Ethenyl-2-hydroxy-3-methoxy-8-oxo-5,11,12,12a,13,13a-hexahydro-6H,8H-pyrano[4',3':4,5]pyrido[2,1-a]isoquinolin-11-yl beta-D-glucopyranoside
| Molecular Formula | C25H31NO10 |
|---|---|
| Molecular Weight | 505.19 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 505.1948 |
| Heavy Atoms | 36 |
| Complexity | 868.0 |
Chemical Identifiers
| CAS Number | 34482-51-4 |
|---|---|
| SMILES | COC1=C(C=C2[C@H]3C[C@H]4[C@H]([C@@H](OC=C4C(=O)N3CCC2=C1)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C=C)O |
| InChIKey | BCYNGTTVQNJTCV-MDXCLUIBSA-N |
Product Overview
Alangiside (CAS 34482-51-4), with molecular formula C25H31NO10 and molecular weight 505.19 g/mol. IUPAC: (1R,15S,16R,17S)-16-ethenyl-4-hydroxy-5-methoxy-15-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-11-one.
Chemical Property Profile of Alangiside
Property Insights of Alangiside
The XLogP value of -0.1 indicates that Alangiside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.0 Ų indicates high polarity, suggesting Alangiside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alangiside has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alangiside?
The CAS number of Alangiside is 34482-51-4.
What is the molecular formula of Alangiside?
The molecular formula of Alangiside is C25H31NO10.
What is the molecular weight of Alangiside?
The molecular weight of Alangiside is 505.19 g/mol.
Where can I buy Alangiside?
You can request a quote for Alangiside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alangiside?
Yes, KEHONG BIO provides custom synthesis services for Alangiside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.