Identification

PhytoHub ID
PHUB000085
Name
Sabinene-hydrate (trans)
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
154.253
Monoisotopic Mass
154.1357652
Chemical Formula
C10H18O
IUPAC Name
(1R,2R,5S)-2-methyl-5-(propan-2-yl)bicyclo[3.1.0]hexan-2-ol
InChI Key
KXSDPILWMGFJMM-AEJSXWLSSA-N
InChI Identifier
InChI=1S/C10H18O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h7-8,11H,4-6H2,1-3H3/t8-,9+,10-/m0/s1
SMILES
CC(C)[C@]12C[C@H]1[C@](C)(O)CC2
Structure

Calculated Properties

Solubility (ALOGPS)
8.10e-01 g/l
LogS (ALOGPS)
-2.28
LogP (ALOGPS)
2.12
Hydrogen Acceptors
1
Hydrogen Donors
1
Rotatable Bond Count
1
Polar Surface Area
20.23
Refractivity
45.5544
Polarizability
18.681223200435564
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-0.9918331508592839
pKa (strongest acidic)
19.131154204711283
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

Spectra from Phytohub

Spectrum TypeInstrument TypeIon ModeCollision Energy LevelViewPeaks

Food Sources

NameGroup
Sweet marjoramHerbs and Spices PublicationsShow

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

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