10-hydroxy-6H-pyrano[3,2-g]chromen-2-one
PubChem CID: 324957
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| Compound Synonyms | NSC292153, NSC-292153 |
|---|---|
| Topological Polar Surface Area | 55.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 16.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 360.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 10-hydroxy-6H-pyrano[3,2-g]chromen-2-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.0 |
| Molecular Formula | C12H8O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | JTVCHHJMCONHTC-UHFFFAOYSA-N |
| Fcsp3 | 0.0833333333333333 |
| Logs | -2.929 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.236 |
| Compound Name | 10-hydroxy-6H-pyrano[3,2-g]chromen-2-one |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 216.042 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 216.042 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 216.19 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.8066904 |
| Inchi | InChI=1S/C12H8O4/c13-9-4-3-8-6-7-2-1-5-15-11(7)10(14)12(8)16-9/h1,3-6,14H,2H2 |
| Smiles | C1C=COC2=C1C=C3C=CC(=O)OC3=C2O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Zanthoxylum Spinosum (Plant) Rel Props:Source_db:cmaup_ingredients