Graveobioside A
precursor
Showing entry for Graveobioside A
Identification
- PhytoHub ID
- PHUB002574
- Name
- Graveobioside A
- Systematic Name
- Not Available
- Synonyms
- 3',4',5,7-Tetrahydroxyflavone; 7-O-[D-Apiofuranosyl-(1→2)-β-D-glucopyranoside]
- 7-{[(2S,3R,4S,5S,6R)-3-{[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-
- CAS Number
- 63808-23-1
- Average Mass
- 580.495
- Monoisotopic Mass
- 580.142820202
- Chemical Formula
- C26H28O15
- IUPAC Name
- Not Available
- InChI Key
- YSXNEFJASLJGTK-YRCFQSNFSA-N
- InChI Identifier
InChI=1S/C26H28O15/c27-7-18-20(33)21(34)22(41-25-23(35)26(36,8-28)9-37-25)24(40-18)38-11-4-14(31)19-15(32)6-16(39-17(19)5-11)10-1-2-12(29)13(30)3-10/h1-6,18,20-25,27-31,33-36H,7-9H2/t18-,20-,21+,22-,23+,24-,25+,26-/m1/s1
- SMILES
O([C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1OC=2C=C3OC(=CC(=O)C3=C(O)C2)C4=CC(O)=C(O)C=C4)CO)[C@@H]5OC[C@@](O)([C@H]5O)CO
- Structure
Structure for Graveobioside A
Calculated Properties
- Solubility (ALOGPS)
- 1.77e+00 g/l
- LogS (ALOGPS)
- -2.52
- LogP (ALOGPS)
- -0.17
- 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 Food Phytochemical
- Family
- Polyphenols
- Class
- Flavonoids
- Sub-class
- Miscellaneous flavonoids
Spectra from Phytohub
| Spectrum Type | Instrument Type | Ion Mode | Collision Energy Level | View | Peaks | |
|---|---|---|---|---|---|---|
Food Sources
No food source information available
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