Identification

PhytoHub ID
PHUB000084
Name
Sabinene-hydrate (cis)
Synonyms
Not Available
CAS Number
Not Available
Average Mass
154.253
Monoisotopic Mass
154.1357652
Chemical Formula
C10H18O
IUPAC Name
(1R,2S,5S)-5-isopropyl-2-methylbicyclo[3.1.0]hexan-2-ol
InChI Key
KXSDPILWMGFJMM-GUBZILKMSA-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
45.554399999999994
Polarizability
18.618354420573827
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-0.9918331508592838
pKa (strongest acidic)
19.131154204711283
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Taxonomy

Family
Terpenoids
Class
Monoterpenoids
Sub-class
Not Available

Spectra

Record IDSourceDescriptionView
JP000248MassBankEI-B Spectrum - -, [M]+*View Spectra
JP000321MassBankEI-B Spectrum - -, [M]+*View Spectra
JP005799MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006595MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006609MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007383MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007542MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007562MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007933MassBankEI-B Spectrum - -, [M]+*View Spectra
JP008386MassBankEI-B Spectrum - -, [M]+*View Spectra

Food Sources

NameGroup
Sweet marjoramHerbs and Spices PublicationsShow

Metabolism

No metabolism information available

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