Piceatannol (cis-)
precursor
Showing entry for Piceatannol (cis-)
Identification
- PhytoHub ID
- PHUB000337
- Name
- Piceatannol (cis-)
- Synonyms
- Not Available
- CAS Number
- Not Available
- Average Mass
- 244.246
- Monoisotopic Mass
- 244.073558866
- Chemical Formula
- C14H12O4
- IUPAC Name
- 4-[(Z)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol
- InChI Key
- CDRPUGZCRXZLFL-UPHRSURJSA-N
- InChI Identifier
InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1-
- SMILES
[H]\C(=C(/[H])C1=CC(O)=CC(O)=C1)C1=CC=C(O)C(O)=C1
- Structure
Calculated Properties
- Solubility (ALOGPS)
- 9.70e-02 g/l
- LogS (ALOGPS)
- -3.40
- LogP (ALOGPS)
- 2.12
- Hydrogen Acceptors
- 4
- Hydrogen Donors
- 4
- Rotatable Bond Count
- 2
- Polar Surface Area
- 80.92
- Refractivity
- 69.43640000000002
- Polarizability
- 24.30150905058958
- Formal Charge
- 0
- Physiological Charge
- 0
- pKa (strongest basic)
- -5.678026138943371
- pKa (strongest acidic)
- 8.905793112852761
External Links
- ChEBI
- 76156
- ChEBI
- 28814
- PubChem
- 6603962
- Chemistry Dashboard
- DTXSID40424968
- FooDB (Compounds)
- FDB012295
Taxonomy
- Family
- Polyphenols
- Class
- Stilbenes
- Sub-class
- Not Available
Spectra
No spectra information available
Food Sources
| Name | Group | |||
|---|---|---|---|---|
| Red wine | Beverages, Alcoholic | Publications | Show | |
| Rosé wine | Beverages, Alcoholic | Publications | Show | |
| White wine | Beverages, Alcoholic | Publications | Show |
Metabolism
No metabolism information available
Piceatannol (cis-)