TL;DR: 14-N-Succinimidocarminomycin (CAS 118850-74-1) is a chemical compound with molecular formula C31H32N2O12 and molecular weight 624.1955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl]pyrrolidine-2,5-dione
Also Known As: 14-N-Succinimidocarminomycin, 1-[2-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl]pyrrolidine-2,5-dione, 3-[(2,5-dioxopyrrolidin-1-yl)acetyl]-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside, Quinoline,2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-6-methoxy-4-methyl, 2,5-Pyrrolidinedione, 1-(2-(4-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-2-naphthacenyl)-2-oxoethyl)-, (2S-cis)-
| Molecular Formula | C31H32N2O12 |
| Molecular Weight | 624.1955 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 223.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 624.1955 Da |
| Heavy Atoms | 45 |
| Complexity | 1230.0 |
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CN6C(=O)CCC6=O)O)N)O |
| InChIKey | RHDRKPUMMVQZKK-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 14-N-Succinimidocarminomycin. The TPSA of 223.0 Ų indicates high polarity, suggesting 14-N-Succinimidocarminomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 14-N-Succinimidocarminomycin has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 14-N-Succinimidocarminomycin is 118850-74-1.
The molecular formula of 14-N-Succinimidocarminomycin is C31H32N2O12.
The molecular weight of 14-N-Succinimidocarminomycin is 624.1955 g/mol.
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