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Gummiferin structure
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Gummiferin

TL;DR: Gummiferin (CAS 35988-26-2) is a chemical compound with molecular formula C31H44K2O18S2 and molecular weight 846.1243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dipotassium;(1S,9R,13R,15R)-15-hydroxy-7-[6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5,5-dicarboxylate

Also Known As: Gummiferin, Carboxyatractyloside, CAT dipotassium salt, C-ATR, Dipotassium carboxyatractyloside

CAS Number
35988-26-2
Molecular Formula
C31H44K2O18S2
Molecular Weight
846.1243 g/mol
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Technical Specifications

Molecular FormulaC31H44K2O18S2
Molecular Weight846.1243 g/mol
XLogP-7.54
Topological Polar Surface Area (TPSA)309.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors18
Rotatable Bonds11
Exact Mass846.1243 Da
Heavy Atoms53
Complexity1590.0
SMILESCC(C)CC(=O)OC1C(C(C(OC1OC2C[C@@]3(C4CC[C@@H]5C[C@]4(CCC3C(C2)(C(=O)[O-])C(=O)[O-])[C@@H](C5=C)O)C)CO)OS(=O)(=O)O)OS(=O)(=O)O.[K+].[K+]
InChIKeyFPJGZZYAZUKPAD-NBKMCPERSA-L

Product Description

Applications: Gummiferin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Gummiferin (CAS 35988-26-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, Gummiferin (CAS 35988-26-2) has the molecular formula C31H44K2O18S2 and a molecular weight of 846.12 g/mol. It is also known as Gummiferin and Carboxyatractyloside.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Gummiferin

XLogP
-7.54
TPSA (Topological Polar Surface Area)
309.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
18
Rotatable Bonds
11
Heavy Atoms
53
Complexity
1590.0
Exact Mass
846.1243
Monoisotopic Mass
846.1243
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 Gummiferin

The XLogP value of -7.54 indicates that Gummiferin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 309.0 Ų indicates high polarity, suggesting Gummiferin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gummiferin has 4 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Gummiferin?

The CAS number of Gummiferin is 35988-26-2.

What is the molecular formula of Gummiferin?

The molecular formula of Gummiferin is C31H44K2O18S2.

What is the molecular weight of Gummiferin?

The molecular weight of Gummiferin is 846.1243 g/mol.

What are the applications of Gummiferin?

Gummiferin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Gummiferin (CAS 35988-26-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy Gummiferin?

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

Does CoreyChem offer custom synthesis for Gummiferin?

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

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