Camphor
precursor
Showing entry for Camphor
Identification
- PhytoHub ID
- PHUB000028
- Name
- Camphor
- Systematic Name
- Not Available
- Synonyms
- Bornan-2-one
- Camphan-2-one
- CAS Number
- Not Available
- Average Mass
- 152.237
- Monoisotopic Mass
- 152.120115135
- Chemical Formula
- C10H16O
- IUPAC Name
- (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
- InChI Key
- DSSYKIVIOFKYAU-XVKPBYJWSA-N
- InChI Identifier
InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10-/m0/s1
- SMILES
CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2
- Structure
Structure for Camphor
Calculated Properties
- Solubility (ALOGPS)
- 8.80e-01 g/l
- LogS (ALOGPS)
- -2.24
- LogP (ALOGPS)
- 2.85
- Hydrogen Acceptors
- 1
- Hydrogen Donors
- 0
- Rotatable Bond Count
- 0
- Polar Surface Area
- 17.07
- Refractivity
- 44.492000000000004
- Polarizability
- 16.949557995549853
- Formal Charge
- 0
- Physiological Charge
- 0
- pKa (strongest basic)
- -7.4857085586657375
- pKa (strongest acidic)
- Not Available
- Number of Rings
- 2
- Rule of Five
- Yes
- Bioavailability
- Yes
- Ghose Filter
- No
- Veber's Rule
- Yes
- MDDR-like Rule
- No
Taxonomy as Food Phytochemical
- Family
- Terpenoids
- Class
- Monoterpenoids
- Sub-class
- Not Available
Classyfire Taxonomy
- Kingdom Name
- Organic compounds
- Class
- Prenol lipids
- Super-class
- Lipids and lipid-like molecules
- Sub-class
- Monoterpenoids
- Direct Parent Name
- Bicyclic monoterpenoids
- Alternative Parent Names
- ["Hydrocarbon derivatives", "Ketones", "Organic oxides"]
- External Descriptor Annotations
- Not Available
- Substituent Names
- ["Aliphatic homopolycyclic compound", "Bicyclic monoterpenoid", "Bornane monoterpenoid", "Carbonyl group", "Hydrocarbon derivative", "Ketone", "Organic oxide", "Organic oxygen compound", "Organooxygen compound"]
Spectra from Online Resources
| Record ID | Source | Description | View |
|---|---|---|---|
| JP000133 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP000910 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP002241 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP002596 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP005732 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP005803 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP005805 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP006591 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP006603 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP006604 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP006607 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP006682 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP007653 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
| JP011329 | MassBank | EI-B Spectrum - -, [M]+* | View Spectra |
Food Sources
| Name | Group | |||
|---|---|---|---|---|
| Cinnamon | Herbs and Spices | Publications | Show | |
| Common sage | Herbs and Spices | Publications | Show | |
| Rosemary | Herbs and Spices | Publications | Show |
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