(+)-Lariciresinol
precursor
Showing entry for (+)-Lariciresinol
Identification
- PhytoHub ID
- PHUB001390
- Name
- (+)-Lariciresinol
- Systematic Name
- Not Available
- Synonyms
- Not Available
- CAS Number
- Not Available
- Average Mass
- 360.406
- Monoisotopic Mass
- 360.157288493
- Chemical Formula
- C20H24O6
- IUPAC Name
- 4-[(2S,3R,4R)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
- InChI Key
- MHXCIKYXNYCMHY-AUSJPIAWSA-N
- InChI Identifier
InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)22)7-14-11-26-20(15(14)10-21)13-4-6-17(23)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3/t14-,15-,20+/m0/s1
- SMILES
COC1=C(O)C=CC(C[C@H]2CO[C@@H]([C@H]2CO)C2=CC(OC)=C(O)C=C2)=C1
- Structure
Structure for (+)-Lariciresinol
Calculated Properties
- Solubility (ALOGPS)
- Not Available
- LogS (ALOGPS)
- Not Available
- LogP (ALOGPS)
- Not Available
- Hydrogen Acceptors
- 6
- Hydrogen Donors
- 3
- Rotatable Bond Count
- 6
- Polar Surface Area
- 88.38000000000001
- Refractivity
- 97.1936
- Polarizability
- 38.04338248225902
- Formal Charge
- 0
- Physiological Charge
- 0
- pKa (strongest basic)
- -2.6393326877037087
- pKa (strongest acidic)
- 9.751300076356019
- Number of Rings
- 3
- Rule of Five
- Yes
- Bioavailability
- Yes
- Ghose Filter
- Yes
- Veber's Rule
- No
- MDDR-like Rule
- Yes
External Links
- ChEBI
- 67246
- PubChem
- 332427
- Chemistry Dashboard
- DTXSID30318362
- MetaboLights
- MTBLC67246
- Phenol-Explorer
- 596
- Exposome Explorer
- 32
- FooDB (Compounds)
- FDB030072
Taxonomy as Food Phytochemical
- Family
- Polyphenols
- Class
- Lignans
- Sub-class
- Not Available
Spectra from Phytohub
Food Sources
Role as Biomarker of intake
No roles as Biomarker of intake found
Metabolism
No metabolism information available
Inter-Individual Variations in Metabolism
No data on inter-individual variations available