metabolite

Showing entry for 6-exo-Hydroxycamphene

Identification

PhytoHub ID
PHUB000959
Name
6-exo-Hydroxycamphene
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
152.237
Monoisotopic Mass
152.120115135
Chemical Formula
C10H16O
IUPAC Name
5,5-dimethyl-6-methylidenebicyclo[2.2.1]heptan-2-ol
InChI Key
KWDIOXFYRVLXFK-UHFFFAOYSA-N
InChI Identifier
InChI=1S/C10H16O/c1-6-8-4-7(5-9(8)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3
SMILES
CC1(C)C2CC(O)C(C2)C1=C
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
2.48e+00 g/l
LogS (ALOGPS)
-1.79
LogP (ALOGPS)
2.26
Hydrogen Acceptors
1
Hydrogen Donors
1
Rotatable Bond Count
0
Polar Surface Area
20.23
Refractivity
45.2423
Polarizability
17.804261038908173
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-1.2332844237327496
pKa (strongest acidic)
18.579139406189416
Number of Rings
2
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
No
Veber's Rule
Yes
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 Phytohub

Spectrum TypeInstrument TypeIon ModeCollision Energy LevelViewPeaks

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 6-exo-HydroxycamphenerabbiturineNot AvailableNot AvailableNot AvailableNot AvailableC10H16O152.120115135 Publications

Inter-Individual Variations in Metabolism

Food PhytochemicalMetaboliteEffectValue
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