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Aspartyl-aspartyl-glutamyl-aspartic acid structure
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Aspartyl-aspartyl-glutamyl-aspartic acid

TL;DR: Aspartyl-aspartyl-glutamyl-aspartic acid (CAS 123354-91-6) is a chemical compound with molecular formula C17H24N4O13 and molecular weight 492.13397 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]amino]butanedioic acid

Also Known As: Asp-asp-glu-asp, Aspartyl-aspartyl-glutamyl-aspartic acid, L-alpha-Aspartyl-L-alpha-aspartyl-L-alpha-glutamyl-L-aspartic acid, (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]amino]butanedioic acid, L-Aspartic acid, N-(N-(N-L-alpha-aspartyl-L-alpha-aspartyl)-L-alpha-glutamyl)-

CAS Number
123354-91-6
Molecular Formula
C17H24N4O13
Molecular Weight
492.13397 g/mol
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Technical Specifications

Molecular FormulaC17H24N4O13
Molecular Weight492.13397 g/mol
XLogP-6.9
Topological Polar Surface Area (TPSA)300.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors14
Rotatable Bonds16
Exact Mass492.13397 Da
Heavy Atoms34
Complexity843.0
SMILESC(CC(=O)O)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)N
InChIKeyPQFMROVJTOPVDF-JBDRJPRFSA-N

Chemical Property Profile of Aspartyl-aspartyl-glutamyl-aspartic acid

XLogP
-6.9
TPSA (Topological Polar Surface Area)
300.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
14
Rotatable Bonds
16
Heavy Atoms
34
Complexity
843.0
Exact Mass
492.13397
Monoisotopic Mass
492.13397
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 Aspartyl-aspartyl-glutamyl-aspartic acid

The XLogP value of -6.9 indicates that Aspartyl-aspartyl-glutamyl-aspartic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 300.0 Ų indicates high polarity, suggesting Aspartyl-aspartyl-glutamyl-aspartic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aspartyl-aspartyl-glutamyl-aspartic acid has 9 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Aspartyl-aspartyl-glutamyl-aspartic acid?

The CAS number of Aspartyl-aspartyl-glutamyl-aspartic acid is 123354-91-6.

What is the molecular formula of Aspartyl-aspartyl-glutamyl-aspartic acid?

The molecular formula of Aspartyl-aspartyl-glutamyl-aspartic acid is C17H24N4O13.

What is the molecular weight of Aspartyl-aspartyl-glutamyl-aspartic acid?

The molecular weight of Aspartyl-aspartyl-glutamyl-aspartic acid is 492.13397 g/mol.

Where can I buy Aspartyl-aspartyl-glutamyl-aspartic acid?

You can request a quote for Aspartyl-aspartyl-glutamyl-aspartic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Aspartyl-aspartyl-glutamyl-aspartic acid?

Yes, CoreyChem provides custom synthesis services for Aspartyl-aspartyl-glutamyl-aspartic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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