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Complanatuside structure
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Complanatuside

TL;DR: Complanatuside (CAS 146501-37-3) is a chemical compound with molecular formula C28H32O16 and molecular weight 624.169 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

Also Known As: Complanatuside, Complanatoside A, Complanatoside, Complanatuside A, complanaruside

CAS Number
146501-37-3
Molecular Formula
C28H32O16
Molecular Weight
624.169 g/mol
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Technical Specifications

Molecular FormulaC28H32O16
Molecular Weight624.169 g/mol
XLogP-0.8
Topological Polar Surface Area (TPSA)255.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors16
Rotatable Bonds8
Exact Mass624.169 Da
Heavy Atoms44
Complexity1020.0
SMILESCOC1=CC(=C2C(=C1)OC(=C(C2=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C4=CC=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O
InChIKeyKKPKUPKKMALLKG-QDYVESOYSA-N

Chemical Property Profile of Complanatuside

XLogP
-0.8
TPSA (Topological Polar Surface Area)
255.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
16
Rotatable Bonds
8
Heavy Atoms
44
Complexity
1020.0
Exact Mass
624.169
Monoisotopic Mass
624.169
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 Complanatuside

The XLogP value of -0.8 indicates that Complanatuside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 255.0 Ų indicates high polarity, suggesting Complanatuside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Complanatuside has 9 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Complanatuside?

The CAS number of Complanatuside is 146501-37-3.

What is the molecular formula of Complanatuside?

The molecular formula of Complanatuside is C28H32O16.

What is the molecular weight of Complanatuside?

The molecular weight of Complanatuside is 624.169 g/mol.

Where can I buy Complanatuside?

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

Does CoreyChem offer custom synthesis for Complanatuside?

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

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