(Ser(1)-admadda(5))microsystin-LR
TL;DR: (Ser(1)-admadda(5))microsystin-LR (CAS 141634-76-6) is a chemical compound with molecular formula C50H74N10O14 and molecular weight 1038.5386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5R,8R,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-acetyloxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-15-[3-(diaminomethylideneamino)propyl]-5-(hydroxymethyl)-1,12,19-trimethyl-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: S-Adnadda-M-LR, (Ser(1)-admadda(5))microsystin-LR, (5R,8R,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-acetyloxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-15-[3-(diaminomethylideneamino)propyl]-5-(hydroxymethyl)-1,12,19-trimethyl-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, Cyanoginosin LA, 2-D-serine-5-L-arginine-6-((2S,4E,6E,8S,9S)-9-(acetyloxy)-4,5,6,7-tetradehydro-2,6,8-trimethyl-10-phenyl-L-3-aminodecanoic acid)-, (5R,8R,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-acetyloxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-15-[3-(diaminomethylideneamino)propyl]-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-h
Technical Specifications
| Molecular Formula | C50H74N10O14 |
| Molecular Weight | 1038.5386 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 380.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 17 |
| Exact Mass | 1038.5386 Da |
| Heavy Atoms | 74 |
| Complexity | 2120.0 |
| 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)CO)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(=O)C)/C |
| InChIKey | LIAFLGINUNSQGF-QKKGDWEISA-N |
Chemical Property Profile of (Ser(1)-admadda(5))microsystin-LR
Property Insights of (Ser(1)-admadda(5))microsystin-LR
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Ser(1)-admadda(5))microsystin-LR. The TPSA of 380.0 Ų indicates high polarity, suggesting (Ser(1)-admadda(5))microsystin-LR may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Ser(1)-admadda(5))microsystin-LR has 11 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (Ser(1)-admadda(5))microsystin-LR?
The CAS number of (Ser(1)-admadda(5))microsystin-LR is 141634-76-6.
What is the molecular formula of (Ser(1)-admadda(5))microsystin-LR?
The molecular formula of (Ser(1)-admadda(5))microsystin-LR is C50H74N10O14.
What is the molecular weight of (Ser(1)-admadda(5))microsystin-LR?
The molecular weight of (Ser(1)-admadda(5))microsystin-LR is 1038.5386 g/mol.
Where can I buy (Ser(1)-admadda(5))microsystin-LR?
You can request a quote for (Ser(1)-admadda(5))microsystin-LR directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Ser(1)-admadda(5))microsystin-LR?
Yes, CoreyChem provides custom synthesis services for (Ser(1)-admadda(5))microsystin-LR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.