Apigenin 4'-O-glucuronide
Showing entry for Apigenin 4'-O-glucuronide
Identification
- PhytoHub ID
- PHUB002978
- Name
- Apigenin 4'-O-glucuronide
- Systematic Name
- Apigenin 4'-O-glucuronide
- Synonyms
- Not Available
- CAS Number
- Not Available
- Average Mass
- 446.364
- Monoisotopic Mass
- 446.0849114
- Chemical Formula
- C21H18O11
- IUPAC Name
- Not Available
- InChI Key
- NKRGFKAFZUDVES-DNLILFCWNA-N
- InChI Identifier
InChI=1/C21H18O11/c22-9-5-11(23)15-12(24)7-13(31-14(15)6-9)8-1-3-10(4-2-8)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16?,17-,18?,19?,21-/s2
- SMILES
OC1C(O)[C@H](OC2=CC=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)OC([C@@H]1O)C(O)=O
- Structure
Structure for Apigenin 4'-O-glucuronide
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
External Links
No external links
Taxonomy as Metabolite
- Family
- (Poly)phenol metabolites
- Class
- Flavonoid metabolites
- Sub-class
- Flavones (parent and host metabolites)
Taxonomy of its Food Phytochemical Precursor(s)
| Food Phytochemical | Family | Class | Sub-class | |
|---|---|---|---|---|
| Apigenin | Polyphenols | Flavonoids | Flavones | Show Food Phytochemical |
Spectra from Phytohub
| Spectrum Type | Instrument Type | Ion Mode | Collision Energy Level | View | Peaks | |
|---|---|---|---|---|---|---|
Food Sources
No food source information available
Food Sources of its Food Phytochemical(s)
| Food Phytochemical | Food Source | Food Source Group | |||
|---|---|---|---|---|---|
| Apigenin | Celery leaves | Herbs and Spices | Publications | Show | |
| Apigenin | Celery stalks | Vegetables, Other vegetables | Publications | Show | |
| Apigenin | Chamomile tea | Teas and herbal teas | Publications | Show | |
| Apigenin | Common oregano | Herbs and Spices | Publications | Show | |
| Apigenin | Globe artichoke | Vegetables, Other vegetables | Publications | Show | |
| Apigenin | Olive, black | Fruit, Drupes | Publications | Show | |
| Apigenin | Olive, green | Fruit, Drupes | Publications | Show | |
| Apigenin | Parsley | Herbs and Spices | Publications | Show |
Role as Biomarker of intake
No roles as Biomarker of intake found
Metabolism
| Food Phytochemical | Metabolite | Species | Biofluids | Origin | TMax | CMax | Urinary Excretion | Formula | Monoisotopic mass | ||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Apigenin | Apigenin 4'-O-glucuronide | human | plasma, urine | host metabolism | Not Available | Not Available | <1% | C21H18O11 | 446.0849114 | Publications |
Inter-Individual Variations in Metabolism
| Food Phytochemical | Metabolite | Effect | Value |
|---|