微囊藻毒素-LR
TL;DR: 微囊藻毒素-LR (CAS 101043-37-2) is a chemical compound with molecular formula C49H74N10O12 and molecular weight 994.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
微囊藻毒素-LR
(5R,8S,11R,12S,15S,18S,19S,22R)-15-[3-(diaminomethylideneamino)propyl]-18-[(1E,3E,5S,6S)-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-LR, Microcystin LR, Cyanoginosin LR, Cyanoginosin-LR, Akerstox
| Molecular Formula | C49H74N10O12 |
|---|---|
| Molecular Weight | 994.55 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 343.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 15 |
| Exact Mass | 994.54877 |
| Heavy Atoms | 71 |
| Complexity | 2000.0 |
Chemical Identifiers
| CAS Number | 101043-37-2 |
|---|---|
| SMILES | C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C |
| InChIKey | ZYZCGGRZINLQBL-GWRQVWKTSA-N |
Product Overview
微囊藻毒素-LR (CAS 101043-37-2), with molecular formula C49H74N10O12 and molecular weight 994.55 g/mol. IUPAC: (5R,8S,11R,12S,15S,18S,19S,22R)-15-[3-(diaminomethylideneamino)propyl]-18-[(1E,3E,5S,6S)-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 微囊藻毒素-LR
Property Insights of 微囊藻毒素-LR
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 微囊藻毒素-LR. The TPSA of 343.0 Ų indicates high polarity, suggesting 微囊藻毒素-LR may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 微囊藻毒素-LR has 10 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 微囊藻毒素-LR?
The CAS number of 微囊藻毒素-LR is 101043-37-2.
What is the molecular formula of 微囊藻毒素-LR?
The molecular formula of 微囊藻毒素-LR is C49H74N10O12.
What is the molecular weight of 微囊藻毒素-LR?
The molecular weight of 微囊藻毒素-LR is 994.55 g/mol.
Where can I buy 微囊藻毒素-LR?
You can request a quote for 微囊藻毒素-LR directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 微囊藻毒素-LR?
Yes, KEHONG BIO provides custom synthesis services for 微囊藻毒素-LR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.