Brevifolincarboxylic acid
7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylic acid
Also Known As: Brevifolincarboxylic acid|Brevifolic acid|BREVIFOLINCARBOXYLICACID|Brevifolin carboxylic acid|Bioevifolincarboxylic acid|Brevifolincarboxylic acid?|HY-N4095R|JFJWMFPFMLRLMI-UHFFFAOYSA-|HY-N4095|Brevifolincarboxylic acid (Standard)|7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylic acid|7,8,9-Trihydroxy-3,5-dioxo-1,2,3,5-tetrahydrocyclopenta[c]isochromene-1-carboxylic acid|7,8,9-trihydroxy-3,5-dioxo-1H,2H,3H,5H-cyclopenta[c]isochromene-1-carboxylic acid|1,2,3,5-Tetrahydro-7,8,9-trihydroxy-3,5-dioxocyclopenta[c][2]benzopyran-1-carboxylic acid|7,8,9-Trihydroxy-3,5-dioxo-1,2,3,5-tetrahydrocyclopenta[c][2]benzopyran-1-carboxylic acid|7,8,9-trihydroxy-3,5-dioxo-1H,2H-cyclopenta[c]isochromene-1-carboxylic acid
| Molecular Formula | C13H8O8 |
|---|---|
| Molecular Weight | 292.0219 g/mol |
| LogP | 0.6644 |
| Topological Polar Surface Area | 145.27 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 292.0219 |
| Monoisotopic Mass | 292.0219 |
| Heavy Atoms | 21 |
| Complexity | 876.0959 |
Chemical Identifiers
| CAS Number | 18490-95-4 |
|---|---|
| SMILES | C1C(C2=C(C1=O)OC(=O)C3=CC(=C(C(=C32)O)O)O)C(=O)O |
Product Overview
Brevifolincarboxylic acid (CAS 18490-95-4), with molecular formula C13H8O8 and molecular weight 292.0219 g/mol. IUPAC: 7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylic acid.
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