conotoxin MI
TL;DR: conotoxin MI (CAS 83481-45-2) is a chemical compound with molecular formula C59H93N21O17S4 and molecular weight 1495.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-6-amino-2-[[2-[[(2R)-2-[[(2S)-2-[[(2S)-1-[2-[[(2R)-2-[[(5S)-5-[(2-aminoacetyl)amino]-8-(diaminomethylideneamino)-4-oxo-2-(sulfanylmethyl)octanoyl]amino]-3-sulfanylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-sulfanylpropanoyl]amino]acetyl]amino]hexanoyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-1-oxo-3-sulfanylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]butanediamide
Also Known As: Conotoxin MI, Conotoxin M1, Conotoxin M I, Conotoxin M-1, Alpha-Conotoxin MI
| Molecular Formula | C59H93N21O17S4 |
|---|---|
| Molecular Weight | 1495.59 g/mol |
| LogP | -9.3355 |
| Topological Polar Surface Area | 629.24 Ų |
| Hydrogen Bond Donors | 24 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 46 |
| Exact Mass | 1495.5941 |
| Heavy Atoms | 101 |
| Complexity | 3209.3643 |
Chemical Identifiers
| CAS Number | 83481-45-2 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N)NC(=O)[C@@H]2CCCN2C(=O)C(CC3=CN=CN3)NC(=O)[C@H](CS)NC(=O)C(CC(=O)[C@H](CCCN=C(N)N)NC(=O)CN)CS |
Product Overview
conotoxin MI (CAS 83481-45-2), with molecular formula C59H93N21O17S4 and molecular weight 1495.59 g/mol. IUPAC: (2S)-2-[[(2S)-6-amino-2-[[2-[[(2R)-2-[[(2S)-2-[[(2S)-1-[2-[[(2R)-2-[[(5S)-5-[(2-aminoacetyl)amino]-8-(diaminomethylideneamino)-4-oxo-2-(sulfanylmethyl)octanoyl]amino]-3-sulfanylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-sulfanylpropanoyl]amino]acetyl]amino]hexanoyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-1-oxo-3-sulfanylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]butanediamide.
Chemical Property Profile of conotoxin MI
Property Insights of conotoxin MI
The XLogP value of -9.3355 indicates that conotoxin MI is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 629.24 Ų indicates high polarity, suggesting conotoxin MI may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, conotoxin MI has 24 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of conotoxin MI?
The CAS number of conotoxin MI is 83481-45-2.
What is the molecular formula of conotoxin MI?
The molecular formula of conotoxin MI is C59H93N21O17S4.
What is the molecular weight of conotoxin MI?
The molecular weight of conotoxin MI is 1495.59 g/mol.
Where can I buy conotoxin MI?
You can request a quote for conotoxin MI directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for conotoxin MI?
Yes, KEHONG BIO provides custom synthesis services for conotoxin MI and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.