metabolite

Showing entry for Camphene-10,2-glycol

Identification

PhytoHub ID
PHUB000958
Name
Camphene-10,2-glycol
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
170.252
Monoisotopic Mass
170.13067982
Chemical Formula
C10H18O2
IUPAC Name
(2S)-2-(hydroxymethyl)-3,3-dimethylbicyclo[2.2.1]heptan-2-ol
InChI Key
CFXJOMGPUADAJE-UHFFFAOYSA-N
InChI Identifier
InChI=1S/C10H18O2/c1-9(2)7-3-4-8(5-7)10(9,12)6-11/h7-8,11-12H,3-6H2,1-2H3/t7?,8?,10-/m0/s1
SMILES
CC1(C)C2CCC(C2)[C@@]1(O)CO
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
1.35e+01 g/l
LogS (ALOGPS)
-1.10
LogP (ALOGPS)
1.58
Hydrogen Acceptors
2
Hydrogen Donors
2
Rotatable Bond Count
1
Polar Surface Area
40.46
Refractivity
46.9441
Polarizability
19.22739446812385
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-3.082676192791503
pKa (strongest acidic)
13.40531771679107
Number of Rings
2
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
Yes
Veber's Rule
No
MDDR-like Rule
No

Taxonomy as Metabolite

Family
Terpenoid metabolites
Class
Monoterpenoid metabolites
Sub-class
Not Available

Taxonomy of its Food Phytochemical Precursor(s)

Food PhytochemicalFamilyClassSub-class
CampheneTerpenoidsMonoterpenoidsNot AvailableShow Food Phytochemical

Spectra from Online Resources

No spectra information available

Food Sources

No food source information available

Food Sources of its Food Phytochemical(s)

Food PhytochemicalFood SourceFood Source Group
CampheneRosemaryHerbs and Spices PublicationsShow

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

Food PhytochemicalMetaboliteSpeciesBiofluidsOriginTMaxCMaxUrinary ExcretionFormulaMonoisotopic mass
Camphene Camphene-10,2-glycolrabbiturineunknownNot AvailableNot AvailableNot AvailableC10H18O2170.13067982 Publications

Inter-Individual Variations in Metabolism

Food PhytochemicalMetaboliteEffectValue
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