leukotriene C-4 sulfone
TL;DR: leukotriene C-4 sulfone (CAS 82890-06-0) is a chemical compound with molecular formula C30H47N3O11S and molecular weight 657.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfonyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid
Also Known As: Leukotriene C-4 sulfone, 5(S)-Hydroxy-6(R)-glutathionyl-7-9-trans-11,14-cis-eicosatetraenoic acid-S,S-dioxide, Glycine, N-(3-((1-(4-carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)sulfonyl)-N-L-gamma-glutamyl-L-alanyl)-, (R-(R*,S*-(E,E,Z,Z)))-, (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfonyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid, (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-[[(2S)-2-amino-5-hydroxy-5-oxopentanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfonyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid
| Molecular Formula | C30H47N3O11S |
|---|---|
| Molecular Weight | 657.29 g/mol |
| LogP | 1.4585 |
| Topological Polar Surface Area | 250.49 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 25 |
| Exact Mass | 657.29315 |
| Heavy Atoms | 45 |
| Complexity | 1179.5366 |
Chemical Identifiers
| CAS Number | 82890-06-0 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\C=C\C=C\[C@H]([C@H](CCCC(=O)O)O)S(=O)(=O)C[C@@H](C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)O)N |
Product Overview
leukotriene C-4 sulfone (CAS 82890-06-0), with molecular formula C30H47N3O11S and molecular weight 657.29 g/mol. IUPAC: (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfonyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid.
Chemical Property Profile of leukotriene C-4 sulfone
Property Insights of leukotriene C-4 sulfone
The XLogP value of 1.4585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for leukotriene C-4 sulfone. The TPSA of 250.49 Ų indicates high polarity, suggesting leukotriene C-4 sulfone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, leukotriene C-4 sulfone has 7 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 leukotriene C-4 sulfone?
The CAS number of leukotriene C-4 sulfone is 82890-06-0.
What is the molecular formula of leukotriene C-4 sulfone?
The molecular formula of leukotriene C-4 sulfone is C30H47N3O11S.
What is the molecular weight of leukotriene C-4 sulfone?
The molecular weight of leukotriene C-4 sulfone is 657.29 g/mol.
Where can I buy leukotriene C-4 sulfone?
You can request a quote for leukotriene C-4 sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for leukotriene C-4 sulfone?
Yes, KEHONG BIO provides custom synthesis services for leukotriene C-4 sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.