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Thesioideoside structure
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Thesioideoside

TL;DR: Thesioideoside (CAS 145937-28-6) is a chemical compound with molecular formula C28H32O17 and molecular weight 640.16394 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one

Also Known As: Thesioideoside, 3-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one, 4H-1-Benzopyran-4-one, 3-((2-O-beta-D-glucopyranosyl-beta-D-galactopyranosyl)oxy)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-, 5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-1-benzopyran-3-yl 2-O-beta-D-glucopyranosyl-beta-D-galactopyranoside

CAS Number
145937-28-6
Molecular Formula
C28H32O17
Molecular Weight
640.16394 g/mol
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Technical Specifications

Molecular FormulaC28H32O17
Molecular Weight640.16394 g/mol
XLogP-0.9
Topological Polar Surface Area (TPSA)275.0 Ų
Hydrogen Bond Donors10
Hydrogen Bond Acceptors17
Rotatable Bonds8
Exact Mass640.16394 Da
Heavy Atoms45
Complexity1060.0
SMILESCOC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O
InChIKeyQWTDVAZCZORTDT-QBUVXBDPSA-N

Chemical Property Profile of Thesioideoside

XLogP
-0.9
TPSA (Topological Polar Surface Area)
275.0
Hydrogen Bond Donors
10
Hydrogen Bond Acceptors
17
Rotatable Bonds
8
Heavy Atoms
45
Complexity
1060.0
Exact Mass
640.16394
Monoisotopic Mass
640.16394
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thesioideoside

The XLogP value of -0.9 indicates that Thesioideoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 275.0 Ų indicates high polarity, suggesting Thesioideoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thesioideoside has 10 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Thesioideoside?

The CAS number of Thesioideoside is 145937-28-6.

What is the molecular formula of Thesioideoside?

The molecular formula of Thesioideoside is C28H32O17.

What is the molecular weight of Thesioideoside?

The molecular weight of Thesioideoside is 640.16394 g/mol.

Where can I buy Thesioideoside?

You can request a quote for Thesioideoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thesioideoside?

Yes, CoreyChem provides custom synthesis services for Thesioideoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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