TL;DR: Jaspisamide C (CAS 149420-78-0) is a chemical compound with molecular formula C45H62N4O12 and molecular weight 850.4364 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-11-[(13E,24Z)-16-hydroxy-10-methoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-4,10-dimethoxy-3,5,9-trimethyl-6-oxoundec-1-enyl]-N-methylformamide
Also Known As: Jaspisamide C, N,N-dibenzyl-2-bromoethanamide, Kabiramide C, 21-O-de(aminocarbonyl)-23,24-didehydro-14-demethoxy-23-demethyl-25-deoxy-25-oxo-, N-[(E)-11-[(13E,24Z)-16-hydroxy-10-methoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl]-4,10-dimethoxy-3,5,9-trimethyl-6-oxoundec-1-enyl]-N-methylformamide, N-((E)-11-((13E,24Z)-16-hydroxy-10-methoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo(24.2.1.12,5.16,9)hentriaconta-1(28),2(31),4,6(30),8,13,24,26(29)-octaen-20-yl)-4,10-dimethoxy-3,5,9-trimethyl-6-oxoundec-1-enyl)-N-methylformamide
| Molecular Formula | C45H62N4O12 |
| Molecular Weight | 850.4364 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 207.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 14 |
| Exact Mass | 850.4364 Da |
| Heavy Atoms | 61 |
| Complexity | 1480.0 |
| SMILES | CC1CC/C=C\C2=NC(=CO2)C3=NC(=CO3)C4=NC(=CO4)C(C(C(=O)/C=C/CC(CC(=O)OC1CC(C(C)CCC(=O)C(C)C(C(C)/C=C/N(C)C=O)OC)OC)O)C)OC |
| InChIKey | XGTLKZLKDQCQIQ-AMFGEKGLSA-N |
The XLogP value of 4.6 indicates that Jaspisamide C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 207.0 Ų indicates high polarity, suggesting Jaspisamide C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Jaspisamide C has 1 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Jaspisamide C is 149420-78-0.
The molecular formula of Jaspisamide C is C45H62N4O12.
The molecular weight of Jaspisamide C is 850.4364 g/mol.
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