Artochamin F
PubChem CID: 16080290
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Artochamin F, 5-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol, 5-((E)-2-(3,4-dihydroxyphenyl)ethenyl)-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol |
|---|---|
| Topological Polar Surface Area | 80.9 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 28.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 539.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol |
| Prediction Hob | 1.0 |
| Xlogp | 6.6 |
| Molecular Formula | C24H28O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | HFLHSAFJULMJNB-YRNVUSSQSA-N |
| Fcsp3 | 0.25 |
| Logs | -2.85 |
| Rotatable Bond Count | 6.0 |
| Logd | 4.105 |
| Compound Name | Artochamin F |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 380.199 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 380.199 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 380.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -6.290743657142857 |
| Inchi | InChI=1S/C24H28O4/c1-15(2)5-9-19-18(11-7-17-8-12-21(25)24(28)13-17)20(10-6-16(3)4)23(27)14-22(19)26/h5-8,11-14,25-28H,9-10H2,1-4H3/b11-7+ |
| Smiles | CC(=CCC1=C(C(=C(C=C1O)O)CC=C(C)C)/C=C/C2=CC(=C(C=C2)O)O)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Solanum Sarrachoides (Plant) Rel Props:Source_db:cmaup_ingredients