8-Hydroxy-2-methyl-2-(4-methylpent-3-enyl)benzo[g]chromene-5,10-dione
PubChem CID: 5320804
Connections displayed (default: 10).
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| Topological Polar Surface Area | 63.6 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 651.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 8-hydroxy-2-methyl-2-(4-methylpent-3-enyl)benzo[g]chromene-5,10-dione |
| Prediction Hob | 1.0 |
| Xlogp | 4.2 |
| Molecular Formula | C20H20O4 |
| Prediction Swissadme | 1.0 |
| Inchi Key | IDVZSGFQQMFFSF-UHFFFAOYSA-N |
| Fcsp3 | 0.3 |
| Logs | -4.799 |
| Rotatable Bond Count | 3.0 |
| Logd | 3.523 |
| Compound Name | 8-Hydroxy-2-methyl-2-(4-methylpent-3-enyl)benzo[g]chromene-5,10-dione |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 324.136 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 324.136 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 324.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.4778312 |
| Inchi | InChI=1S/C20H20O4/c1-12(2)5-4-9-20(3)10-8-15-17(22)14-7-6-13(21)11-16(14)18(23)19(15)24-20/h5-8,10-11,21H,4,9H2,1-3H3 |
| Smiles | CC(=CCCC1(C=CC2=C(O1)C(=O)C3=C(C2=O)C=CC(=C3)O)C)C |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Stereospermum Kunthianum (Plant) Rel Props:Source_db:cmaup_ingredients