Pradimicin O
(2R)-2-[[(5R)-1,5,9,14-tetrahydroxy-7,11-dimethoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoic acid
| Molecular Formula | C29H25NO11 |
|---|---|
| Molecular Weight | 563.5 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 200.0 A2 |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 563.14276 |
| Heavy Atoms | 41 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 132971-64-3 |
|---|---|
| SMILES | CC1=CC2=C(C3=C(CC2O)C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC(=C5)OC)O)OC)C(=C1C(=O)NC(C)C(=O)O)O |
| InChIKey | BBIMHVVAVXBCFV-MEBBXXQBSA-N |
📖 Product Overview
Pradimicin O (CAS: 132971-64-3) is a chemical compound with molecular formula C29H25NO11 and molecular weight 563.5 g/mol. Its IUPAC systematic name is (2R)-2-[[(5R)-1,5,9,14-tetrahydroxy-7,11-dimethoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoic acid.
BBIMHVVAVXBCFV-MEBBXXQBSA-N.
SMILES: CC1=CC2=C(C3=C(CC2O)C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC(=C5)OC)O)OC)C(=C1C(=O)NC(C)C(=O)O)O.
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