Litorin
TL;DR: Litorin (CAS 55749-97-8) is a chemical compound with molecular formula C51H68N14O11S and molecular weight 1084.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanediamide
Also Known As: litorin, Litorine, Litorin (peptide), 2-Bromo-3-methoxybenzoicacid, 2-De-L-Val-3-de-L-Pro-ranatensin
| Molecular Formula | C51H68N14O11S |
|---|---|
| Molecular Weight | 1084.49 g/mol |
| LogP | -2.1129 |
| Topological Polar Surface Area | 392.55 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 30 |
| Exact Mass | 1084.4912 |
| Heavy Atoms | 77 |
| Complexity | 2737.2744 |
Chemical Identifiers
| CAS Number | 55749-97-8 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]5CCC(=O)N5 |
Product Overview
Litorin (CAS 55749-97-8), with molecular formula C51H68N14O11S and molecular weight 1084.49 g/mol. IUPAC: (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanediamide.
Chemical Property Profile of Litorin
Property Insights of Litorin
The XLogP value of -2.1129 indicates that Litorin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 392.55 Ų indicates high polarity, suggesting Litorin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Litorin has 13 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 Litorin?
The CAS number of Litorin is 55749-97-8.
What is the molecular formula of Litorin?
The molecular formula of Litorin is C51H68N14O11S.
What is the molecular weight of Litorin?
The molecular weight of Litorin is 1084.49 g/mol.
Where can I buy Litorin?
You can request a quote for Litorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Litorin?
Yes, KEHONG BIO provides custom synthesis services for Litorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.