Dihydroisodesmosine
TL;DR: Dihydroisodesmosine (CAS 6038-38-6) is a chemical compound with molecular formula C24H41N5O8 and molecular weight 527.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-6-[2-[(4S)-4-amino-4-carboxybutyl]-3,5-bis(4-aminooxy-4-oxobutyl)-2H-pyridin-1-yl]hexanoic acid
Also Known As: Dihydroisodesmosine, 6-{2-[(4s)-4-amino-4-carboxybutyl]-3,5-bis[4-(aminooxy)-4-oxobutyl]pyridin-1(2h)-yl}-l-norleucine, 3,5-Pyridinedibutanoic acid, alpha,alpha'-diamino-2-(4-amino-4-carboxybutyl)-1-(5-amino-5-carboxypentyl)-1,2-dihydro-, (2S)-2-amino-6-[2-[(4S)-4-amino-4-carboxybutyl]-3,5-bis(4-aminooxy-4-oxobutyl)-2H-pyridin-1-yl]hexanoic acid, (2S)-2-amino-6-[2-[(4S)-4-amino-5-hydroxy-5-oxopentyl]-3,5-bis(4-aminooxy-4-oxobutyl)-2H-pyridin-1-yl]hexanoic acid
| Molecular Formula | C24H41N5O8 |
|---|---|
| Molecular Weight | 527.30 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 235.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 21 |
| Exact Mass | 527.29553 |
| Heavy Atoms | 37 |
| Complexity | 832.0 |
Chemical Identifiers
| CAS Number | 6038-38-6 |
|---|---|
| SMILES | C1=C(C(N(C=C1CCCC(=O)ON)CCCC[C@@H](C(=O)O)N)CCC[C@@H](C(=O)O)N)CCCC(=O)ON |
| InChIKey | ZWDCHHKAHKTXRQ-NFBCFJMWSA-N |
Product Overview
Dihydroisodesmosine (CAS 6038-38-6), with molecular formula C24H41N5O8 and molecular weight 527.30 g/mol. IUPAC: (2S)-2-amino-6-[2-[(4S)-4-amino-4-carboxybutyl]-3,5-bis(4-aminooxy-4-oxobutyl)-2H-pyridin-1-yl]hexanoic acid.
Chemical Property Profile of Dihydroisodesmosine
Property Insights of Dihydroisodesmosine
The XLogP value of -5.2 indicates that Dihydroisodesmosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 235.0 Ų indicates high polarity, suggesting Dihydroisodesmosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dihydroisodesmosine has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydroisodesmosine?
The CAS number of Dihydroisodesmosine is 6038-38-6.
What is the molecular formula of Dihydroisodesmosine?
The molecular formula of Dihydroisodesmosine is C24H41N5O8.
What is the molecular weight of Dihydroisodesmosine?
The molecular weight of Dihydroisodesmosine is 527.30 g/mol.
Where can I buy Dihydroisodesmosine?
You can request a quote for Dihydroisodesmosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroisodesmosine?
Yes, KEHONG BIO provides custom synthesis services for Dihydroisodesmosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.