TL;DR: MM 47761 (CAS 150133-00-9) is a chemical compound with molecular formula C72H86ClN9O28 and molecular weight 1559.5271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-22-(2-amino-2-oxoethyl)-15-chloro-48-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-18,32,35,37-tetrahydroxy-19-[[4-methyl-2-(methylamino)pentanoyl]amino]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3(50),4,6(49),8(48),9,11,14,16,29(45),30,32,34(39),35,37,46-pentadecaene-40-carboxylic acid
Also Known As: Decaplanin, MM 47761, M86-1410, M 861410, 2-(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-22-(2-amino-2-oxoethyl)-15-chloro-48-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-18,32,35,37-tetrahydroxy-19-[[4-methyl-2-(methylamino)pentanoyl]amino]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3(50),4,6(49),8(48),9,11,14,16,29(45),30,32,34(39),35,37,46-pentadecaene-40-carboxylic acid
| Molecular Formula | C72H86ClN9O28 |
| Molecular Weight | 1559.5271 g/mol |
| XLogP | -4.3 |
| Topological Polar Surface Area (TPSA) | 589.0 Ų |
| Hydrogen Bond Donors | 21 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 15 |
| Exact Mass | 1559.5271 Da |
| Heavy Atoms | 110 |
| Complexity | 3230.0 |
| SMILES | CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)C(C(C(=O)NC(C(=O)NC5C(=O)NC7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)C(NC(=O)C(C(C1=CC=C(O4)C=C1)OC1CC(C(C(O1)C)O)(C)N)NC7=O)C(=O)O)CC(=O)N)NC(=O)C(CC(C)C)NC)O)Cl)CO)O)O)O)O)O |
| InChIKey | SJSZMXQSCZCGFO-UHFFFAOYSA-N |
The XLogP value of -4.3 indicates that MM 47761 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 589.0 Ų indicates high polarity, suggesting MM 47761 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, MM 47761 has 21 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of MM 47761 is 150133-00-9.
The molecular formula of MM 47761 is C72H86ClN9O28.
The molecular weight of MM 47761 is 1559.5271 g/mol.
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