Microcystin-LY
TL;DR: Microcystin-LY (CAS 123304-10-9) is a chemical compound with molecular formula C52H71N7O13 and molecular weight 1001.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-[(4-hydroxyphenyl)methyl]-18-(6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl)-1,5,12,19-tetramethyl-2-methylidene-8-(2-methylpropyl)-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid
Also Known As: Microcystin-LY, 15-[(4-hydroxyphenyl)methyl]-18-[(1Z,3E)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,5,12,19-tetramethyl-2-methylidene-8-(2-methylpropyl)-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid
| Molecular Formula | C52H71N7O13 |
|---|---|
| Molecular Weight | 1001.51 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 299.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 13 |
| Exact Mass | 1001.511 |
| Heavy Atoms | 72 |
| Complexity | 1990.0 |
Chemical Identifiers
| CAS Number | 123304-10-9 |
|---|---|
| SMILES | CC1C(NC(=O)C(NC(=O)C(C(NC(=O)C(NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CC2=CC=C(C=C2)O)C=CC(=CC(C)C(CC3=CC=CC=C3)OC)C |
| InChIKey | SIGQAYSWORHPPH-UHFFFAOYSA-N |
Product Overview
Microcystin-LY (CAS 123304-10-9), with molecular formula C52H71N7O13 and molecular weight 1001.51 g/mol. IUPAC: 15-[(4-hydroxyphenyl)methyl]-18-(6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl)-1,5,12,19-tetramethyl-2-methylidene-8-(2-methylpropyl)-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid.
Chemical Property Profile of Microcystin-LY
Property Insights of Microcystin-LY
The XLogP value of 4.7 indicates that Microcystin-LY is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 299.0 Ų indicates high polarity, suggesting Microcystin-LY may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Microcystin-LY has 9 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 Microcystin-LY?
The CAS number of Microcystin-LY is 123304-10-9.
What is the molecular formula of Microcystin-LY?
The molecular formula of Microcystin-LY is C52H71N7O13.
What is the molecular weight of Microcystin-LY?
The molecular weight of Microcystin-LY is 1001.51 g/mol.
Where can I buy Microcystin-LY?
You can request a quote for Microcystin-LY directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Microcystin-LY?
Yes, KEHONG BIO provides custom synthesis services for Microcystin-LY and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.