Glepidotin D
PubChem CID: 486505
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Glepidotin D, 5-[2-(3-hydroxyphenyl)ethyl]-3-(3-methylbut-2-enoxy)-2-(3-methylbut-2-enyl)phenol, phenol, 5-[2-(3-hydroxyphenyl)ethyl]-2-(3-methyl-2-butenyl)-3-[(3-methyl-2-butenyl)oxy]-, 5-[2-(3-Hydroxy-phenyl)-ethyl]-2-(3-methyl-but-2-enyl)-3-(3-methyl-but-2-enyloxy)-phenol, 2-(3-Methyl-2-butenyl)-3-O-(3-methyl-2-butenyl)-5-[2-(3-hydroxyphenyl)ethyl]-1,3-benzenediol, 5-[2-(3-hydroxyphenyl)ethyl]-2-(3-methylbut-2-en-1-yl)-3-[(3-methylbut-2-en-1-yl)oxy]phenol, 5-(2-(3-hydroxyphenyl)ethyl)-3-(3-methylbut-2-enoxy)-2-(3-methylbut-2-enyl)phenol, phenol, 5-(2-(3-hydroxyphenyl)ethyl)-2-(3-methyl-2-butenyl)-3-((3-methyl-2-butenyl)oxy)-, 2-(3-Methyl-2-butenyl)-3-O-(3-methyl-2-butenyl)-5-(2-(3-hydroxyphenyl)ethyl)-1,3-benzenediol, 5-(2-(3-Hydroxy-phenyl)-ethyl)-2-(3-methyl-but-2-enyl)-3-(3-methyl-but-2-enyloxy)-phenol, 5-(2-(3-hydroxyphenyl)ethyl)-2-(3-methylbut-2-en-1-yl)-3-((3-methylbut-2-en-1-yl)oxy)phenol, 3-((2E)-3-Methylbut-2-enyloxy)-2-((2Z)-3-methylbut-2-enyl)-5-[2-(3-hydroxyphenyl)ethyl]phenol |
|---|---|
| Topological Polar Surface Area | 49.7 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 27.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 488.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-[2-(3-hydroxyphenyl)ethyl]-3-(3-methylbut-2-enoxy)-2-(3-methylbut-2-enyl)phenol |
| Prediction Hob | 1.0 |
| Xlogp | 6.8 |
| Molecular Formula | C24H30O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | PXJDPPLCQZVKRC-UHFFFAOYSA-N |
| Fcsp3 | 0.3333333333333333 |
| Logs | -3.671 |
| Rotatable Bond Count | 8.0 |
| Logd | 4.763 |
| Compound Name | Glepidotin D |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 366.219 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 366.219 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 366.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -6.209795088888891 |
| Inchi | InChI=1S/C24H30O3/c1-17(2)8-11-22-23(26)15-20(16-24(22)27-13-12-18(3)4)10-9-19-6-5-7-21(25)14-19/h5-8,12,14-16,25-26H,9-11,13H2,1-4H3 |
| Smiles | CC(=CCC1=C(C=C(C=C1OCC=C(C)C)CCC2=CC(=CC=C2)O)O)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Glycyrrhiza Lepidota (Plant) Rel Props:Source_db:cmaup_ingredients