Eryvarin G
PubChem CID: 5317213
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Eryvarin G, 7-(2,4-dihydroxyphenoxy)-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-g]chromen-6-one, 3-(2,4-dihydroxyphenoxy)-8-(3,3-dimethylallyl)-2,2-dimethylpyrano(5,6:6,7)chromen-4-one, 7-(2,4-dihydroxyphenoxy)-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano(3,2-g)chromen-6-one |
|---|---|
| Topological Polar Surface Area | 85.2 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 31.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 777.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 7-(2,4-dihydroxyphenoxy)-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-g]chromen-6-one |
| Prediction Hob | 1.0 |
| Xlogp | 5.4 |
| Molecular Formula | C25H24O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | JRLYIMPHEWEJIU-UHFFFAOYSA-N |
| Fcsp3 | 0.24 |
| Logs | -2.74 |
| Rotatable Bond Count | 4.0 |
| Logd | 4.124 |
| Compound Name | Eryvarin G |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 420.157 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 420.157 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 420.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.280093683870968 |
| Inchi | InChI=1S/C25H24O6/c1-14(2)5-7-17-23-15(9-10-25(3,4)31-23)11-18-22(28)21(13-29-24(17)18)30-20-8-6-16(26)12-19(20)27/h5-6,8-13,26-27H,7H2,1-4H3 |
| Smiles | CC(=CCC1=C2C(=CC3=C1OC=C(C3=O)OC4=C(C=C(C=C4)O)O)C=CC(O2)(C)C)C |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Erythrina Variegata (Plant) Rel Props:Source_db:cmaup_ingredients