6-S-Cysteinyldopa
TL;DR: 6-S-Cysteinyldopa (CAS 64003-39-0) is a chemical compound with molecular formula C12H16N2O6S and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[2-[(2R)-2-amino-2-carboxyethyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid
Also Known As: 6-S-Cysteinyldopa, L-Tyrosine, 2-((2-amino-2-carboxyethyl)thio)-5-hydroxy-, (R)-, (2S)-2-amino-3-[2-[(2R)-2-amino-2-carboxyethyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid, 2-{[(2R)-2-Amino-2-carboxyethyl]sulfanyl}-5-hydroxy-L-tyrosine, (2S)-2-amino-3-[2-[(2R)-2-amino-3-hydroxy-3-oxopropyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid
| Molecular Formula | C12H16N2O6S |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.0729 |
| Heavy Atoms | 21 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 64003-39-0 |
|---|---|
| SMILES | C1=C(C(=CC(=C1O)O)SC[C@@H](C(=O)O)N)C[C@@H](C(=O)O)N |
| InChIKey | GPKIWIHPQUXQCW-BQBZGAKWSA-N |
Product Overview
6-S-Cysteinyldopa (CAS 64003-39-0), with molecular formula C12H16N2O6S and molecular weight 316.07 g/mol. IUPAC: (2S)-2-amino-3-[2-[(2R)-2-amino-2-carboxyethyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid.
Chemical Property Profile of 6-S-Cysteinyldopa
Property Insights of 6-S-Cysteinyldopa
The XLogP value of -5.2 indicates that 6-S-Cysteinyldopa is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting 6-S-Cysteinyldopa may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-S-Cysteinyldopa has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-S-Cysteinyldopa?
The CAS number of 6-S-Cysteinyldopa is 64003-39-0.
What is the molecular formula of 6-S-Cysteinyldopa?
The molecular formula of 6-S-Cysteinyldopa is C12H16N2O6S.
What is the molecular weight of 6-S-Cysteinyldopa?
The molecular weight of 6-S-Cysteinyldopa is 316.07 g/mol.
Where can I buy 6-S-Cysteinyldopa?
You can request a quote for 6-S-Cysteinyldopa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-S-Cysteinyldopa?
Yes, KEHONG BIO provides custom synthesis services for 6-S-Cysteinyldopa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.