Identification

PhytoHub ID
PHUB000972
Name
Dihydrocarveol
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
154.253
Monoisotopic Mass
154.1357652
Chemical Formula
C10H18O
IUPAC Name
dihydrocarveol
InChI Key
KRCZYMFUWVJCLI-UHFFFAOYNA-N
InChI Identifier
InChI=1/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-11H,1,4-6H2,2-3H3
SMILES
CC1CCC(CC1O)C(C)=C
Structure

Calculated Properties

Solubility (ALOGPS)
1.32e+00 g/l
LogS (ALOGPS)
-2.07
LogP (ALOGPS)
2.70
Hydrogen Acceptors
1
Hydrogen Donors
1
Rotatable Bond Count
1
Polar Surface Area
20.23
Refractivity
47.2228
Polarizability
19.04506805301555
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-1.051561774405684
pKa (strongest acidic)
18.994600424312566
Number of Rings
1
Rule of Five
Yes
Bioavailability
Yes
Ghose Filter
No
Veber's Rule
Yes
MDDR-like Rule
No

Precursor Taxonomy

PrecursorFamilyClassSub-class
CarvoneTerpenoidsMonoterpenoidsNot AvailableShow Precursor

Spectra

No spectra information available

Food Sources

PrecursorFood SourceFood Source Group
CarvoneCarawayHerbs and Spices PublicationsShow
CarvoneDillHerbs and Spices PublicationsShow
CarvoneMandarin orange (Clementine, Tangerine)Fruit, Citrus PublicationsShow

Metabolism

PrecursorMetaboliteSpeciesBiofluidsOriginFormulaMonoisotopic mass
Carvone Dihydrocarveolhumanurine (minor)Not AvailableC10H18O154.1357652 Publications
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