4-hydroxy-7-cineolic acid
Showing entry for 4-hydroxy-7-cineolic acid
Identification
- PhytoHub ID
- PHUB003054
- Name
- 4-hydroxy-7-cineolic acid
- Systematic Name
- 4-hydroxy-1,8-epoxy-p-menthan-7-oic acid
- Synonyms
- Not Available
- CAS Number
- Not Available
- Average Mass
- 200.234
- Monoisotopic Mass
- 200.104858995
- Chemical Formula
- C10H16O4
- IUPAC Name
- Not Available
- InChI Key
- LSEPOHWNZOWWQA-UHFFFAOYSA-N
- InChI Identifier
InChI=1S/C10H16O4/c1-8(2)10(13)5-3-9(14-8,4-6-10)7(11)12/h13H,3-6H2,1-2H3,(H,11,12)
- SMILES
CC1(C)OC2(CCC1(O)CC2)C(O)=O
- Structure
Structure for 4-hydroxy-7-cineolic acid
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)
- 3.915750182113749
- 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
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