(E)-4,4'-(ethene-1,2-diyl)bis(2-methoxyphenol)
PubChem CID: 5280698
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| Compound Synonyms | 7329-69-3, 4-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2-methoxyphenol, lignostilbene, 1,2-Bis(4-hydroxy-3-methoxyphenyl)ethylene, 3,3'-dimethoxystilbene-4,4'-diol, (E)-4,4'-(ethene-1,2-diyl)bis(2-methoxyphenol), CHEBI:36390, 3,3'-dimethoxy-trans-stilbene-4,4'-diol, 4,4'-dihydroxy-3,3'-dimethoxystilbene, C04547, SCHEMBL671149, SCHEMBL671150, Phenol, 4,4'-(1E)-1,2-ethenediylbis[2-methoxy-, CHEMBL2260731, CHEBI:17501, KQPXJFAYGYIGRU-ONEGZZNKSA-N, DTXSID801272852, AKOS001650956, CCG-355960, (e)-3,3'-dimethoxy-4,4'-dihydroxystilbene, 4,4'-ethene-1,2-diylbis(2-methoxyphenol), 2,2'-dimethoxy-4,4'-(ethene-1,2-diyl)diphenol, 4,4'-(E)-ethene-1,2-diylbis(2-methoxyphenol), SR-01000479024, (E)-3,3a(2)-Dimethoxy-4,4a(2)-dihydroxystilbene, 4,4'-[(E)-ethene-1,2-diyl]bis(2-methoxyphenol), SR-01000479024-1, Q27102428, Q27116805, 2,2'-dimethoxy-4,4'-[(1E)-ethene-1,2-diyl]diphenol, F9995-2665, 4-[(1E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2-methoxyphenol, 943-241-5, V5P |
|---|---|
| Topological Polar Surface Area | 58.9 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 288.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2-methoxyphenol |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | 3.4 |
| Is Pains | False |
| Molecular Formula | C16H16O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | KQPXJFAYGYIGRU-ONEGZZNKSA-N |
| Fcsp3 | 0.125 |
| Rotatable Bond Count | 4.0 |
| Compound Name | (E)-4,4'-(ethene-1,2-diyl)bis(2-methoxyphenol) |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 272.105 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 272.105 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 272.29 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -4.177859999999999 |
| Inchi | InChI=1S/C16H16O4/c1-19-15-9-11(5-7-13(15)17)3-4-12-6-8-14(18)16(10-12)20-2/h3-10,17-18H,1-2H3/b4-3+ |
| Smiles | COC1=C(C=CC(=C1)/C=C/C2=CC(=C(C=C2)O)OC)O |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Lepechinia Caulescens (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Maprounea Guianensis (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Peritassa Campestris (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Pseudotsuga Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients