5,6-Dihydroxy-7-phenylphenalen-1-one
PubChem CID: 193093
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| Compound Synonyms | 28241-21-6, 5,6-dihydroxy-7-phenyl-1h-phenalen-1-one, 5,6-dihydroxy-7-phenylphenalen-1-one, 1H-Phenalen-1-one,2,6-dihydroxy-9-phenyl-, 1H-phenalen-1-one, 2,6-dihydroxy-9-phenyl-, Phenylphenalenon, DTXSID30950963, CHEBI:188544, 9-phenyl-2,6-dihydroxyphenalen-1(6)-one |
|---|---|
| Topological Polar Surface Area | 57.5 |
| Hydrogen Bond Donor Count | 2.0 |
| Inchi Key | PLZOCIOZMOKLDX-UHFFFAOYSA-N |
| Rotatable Bond Count | 1.0 |
| Heavy Atom Count | 22.0 |
| Compound Name | 5,6-Dihydroxy-7-phenylphenalen-1-one |
| Exact Mass | 288.079 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 288.079 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 465.0 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 288.3 |
| Database Name | npass_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5,6-dihydroxy-7-phenylphenalen-1-one |
| Total Atom Stereocenter Count | 0.0 |
| Nih Violation | False |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C19H12O3/c20-15-9-6-12-10-16(21)19(22)18-13(7-8-14(15)17(12)18)11-4-2-1-3-5-11/h1-10,21-22H |
| Smiles | C1=CC=C(C=C1)C2=C3C4=C(C=C2)C(=O)C=CC4=CC(=C3O)O |
| Xlogp | 4.1 |
| Is Pains | True |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C19H12O3 |
- 1. Outgoing r'ship
FOUND_INto/from Terminalia Catappa (Plant) Rel Props:Source_db:npass_chem_all