Griseoxanthone C
PubChem CID: 5377910
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| Compound Synonyms | Griseoxanthone C, 3569-83-3, 1,6-dihydroxy-3-methoxy-8-methylxanthen-9-one, MJH6MPF38T, 1,6-Dihydroxy-3-methoxy-8-methyl-9H-xanthen-9-one, 9H-Xanthen-9-one, 1,6-dihydroxy-3-methoxy-8-methyl-, UNII-MJH6MPF38T, Xanthen-9-one, 1,6-dihydroxy-3-methoxy-8-methyl-, Compound NP-012637, CHEMBL4081067, CHEBI:181512, DTXSID001234012, AKOS040739057, 3,8-dihydroxy-6-methoxy-1-methylxanthone, 1,6-dihydroxy-3-methoxy-8-methyl-xanthen-9-one, 1,6-Dihydroxy-3-methoxy-8-methyl-9H-xanthen-9-one #, NCGC00380279-01!1,6-dihydroxy-3-methoxy-8-methylxanthen-9-one |
|---|---|
| Topological Polar Surface Area | 76.0 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 384.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,6-dihydroxy-3-methoxy-8-methylxanthen-9-one |
| Prediction Hob | 1.0 |
| Xlogp | 3.1 |
| Molecular Formula | C15H12O5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | UIKVQKMDLQHSKA-UHFFFAOYSA-N |
| Fcsp3 | 0.1333333333333333 |
| Logs | -3.433 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.881 |
| Compound Name | Griseoxanthone C |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 272.068 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 272.068 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 272.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.2983872 |
| Inchi | InChI=1S/C15H12O5/c1-7-3-8(16)4-11-13(7)15(18)14-10(17)5-9(19-2)6-12(14)20-11/h3-6,16-17H,1-2H3 |
| Smiles | CC1=CC(=CC2=C1C(=O)C3=C(C=C(C=C3O2)OC)O)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Scilla Scilloides (Plant) Rel Props:Source_db:cmaup_ingredients