precursor

Showing entry for Secoisolariciresinol diglucoside

Identification

PhytoHub ID
PHUB002967
Name
Secoisolariciresinol diglucoside
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
686.704
Monoisotopic Mass
686.278585401
Chemical Formula
C32H46O16
IUPAC Name
Not Available
InChI Key
SBVBJPHMDABKJV-GPVSADJTNA-N
InChI Identifier
InChI=1/C32H46O16/c1-43-21-9-15(3-5-19(21)35)7-17(13-45-31-29(41)27(39)25(37)23(11-33)47-31)18(8-16-4-6-20(36)22(10-16)44-2)14-46-32-30(42)28(40)26(38)24(12-34)48-32/h3-6,9-10,17-18,23-42H,7-8,11-14H2,1-2H3/t17-,18-,23+,24+,25+,26+,27-,28-,29+,30+,31+,32?/s2
SMILES
COC1=C(O)C=CC(C[C@@H](COC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC2=CC(OC)=C(O)C=C2)=C1
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
Not Available
LogS (ALOGPS)
Not Available
LogP (ALOGPS)
Not Available
Hydrogen Acceptors
Not Available
Hydrogen Donors
Not Available
Rotatable Bond Count
Not Available
Polar Surface Area
Not Available
Refractivity
Not Available
Polarizability
Not Available
Formal Charge
Not Available
Physiological Charge
Not Available
pKa (strongest basic)
Not Available
pKa (strongest acidic)
Not Available
Number of Rings
Not Available
Rule of Five
No
Bioavailability
No
Ghose Filter
No
Veber's Rule
No
MDDR-like Rule
No

Taxonomy as Food Phytochemical

Family
Polyphenols
Class
Lignans
Sub-class
Not Available

Spectra from Online Resources

No spectra information available

Spectra from Phytohub

Spectrum TypeDescriptionSplash KeyDeposition DateView

Food Sources

No food source information available

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

Food PhytochemicalMetaboliteSpeciesBiofluidsOriginTMaxCMaxUrinary ExcretionFormulaMonoisotopic mass
Secoisolariciresinol diglucoside EnterodiolNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableC18H22O4302.151809188 Detailed Intervention Studies
Secoisolariciresinol diglucoside EnterolactoneNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableC18H18O4298.12050906 Detailed Intervention Studies
Secoisolariciresinol diglucoside (+)-MatairesinolNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableNot AvailableC20H22O6358.141638428 Detailed Intervention Studies

Inter-Individual Variations in Metabolism

Food PhytochemicalMetaboliteEffectValue
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