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Phosphopantetheine structure
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Phosphopantetheine

TL;DR: Phosphopantetheine (CAS 2226-71-3) is a chemical compound with molecular formula C11H23N2O7PS and molecular weight 358.09634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butyl] dihydrogen phosphate

Also Known As: Phosphopantetheine, pantetheine 4'-phosphate, 4'-phosphopantetheine, pantotheine-4'-phosphate, Psh-4'-P

CAS Number
2226-71-3
Molecular Formula
C11H23N2O7PS
Molecular Weight
358.09634 g/mol
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Application Areas

Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (3 patents) Biotechnology (18 patents) Heterocyclic Building Blocks (4 patents) Peptides & Amino Acids (2 patents) Pharmaceutical Intermediates (6 patents)

Technical Specifications

Molecular FormulaC11H23N2O7PS
Molecular Weight358.09634 g/mol
XLogP-2.1
Topological Polar Surface Area (TPSA)146.0 Ų
Hydrogen Bond Donors6
Hydrogen Bond Acceptors8
Rotatable Bonds10
Exact Mass358.09634 Da
Heavy Atoms22
Complexity427.0
SMILESCC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O
InChIKeyJDMUPRLRUUMCTL-UHFFFAOYSA-N

Product Description

Applications: Phosphopantetheine is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Phosphopantetheine is a biotechnology compound identified by CAS number 2226-71-3 and the molecular formula C11H23N2O7PS and a molecular weight of 358.1 g/mol. Synonyms include Phosphopantetheine and pantetheine 4'-phosphate.

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 Phosphopantetheine

XLogP
-2.1
TPSA (Topological Polar Surface Area)
146.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
8
Rotatable Bonds
10
Heavy Atoms
22
Complexity
427.0
Exact Mass
358.09634
Monoisotopic Mass
358.09634
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 Phosphopantetheine

The XLogP value of -2.1 indicates that Phosphopantetheine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting Phosphopantetheine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phosphopantetheine has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Phosphopantetheine?

The CAS number of Phosphopantetheine is 2226-71-3.

What is the molecular formula of Phosphopantetheine?

The molecular formula of Phosphopantetheine is C11H23N2O7PS.

What is the molecular weight of Phosphopantetheine?

The molecular weight of Phosphopantetheine is 358.09634 g/mol.

What are the applications of Phosphopantetheine?

Phosphopantetheine is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg...

Where can I buy Phosphopantetheine?

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

Does CoreyChem offer custom synthesis for Phosphopantetheine?

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

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