Identification

PhytoHub ID
PHUB001863
Name
Falcarinol
Synonyms
  • Panaxynol
CAS Number
21852-80-2
Average Mass
244.378
Monoisotopic Mass
244.182715393
Chemical Formula
C17H24O
IUPAC Name
falcarinol
InChI Key
UGJAEDFOKNAMQD-QXPKXGMISA-N
InChI Identifier
InChI=1S/C17H24O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h4,10-11,17-18H,2-3,5-9,12H2,1H3/b11-10-/t17-/m1/s1
SMILES
CCCCCCC\C=C/CC#CC#C[C@H](O)C=C
Structure

Calculated Properties

Solubility (ALOGPS)
3.18e-03 g/l
LogS (ALOGPS)
-4.89
LogP (ALOGPS)
5.78
Hydrogen Acceptors
1
Hydrogen Donors
1
Rotatable Bond Count
11
Polar Surface Area
20.23
Refractivity
81.2642
Polarizability
31.554960622265504
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-3.547011950962667
pKa (strongest acidic)
13.289410263002587
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Taxonomy

Family
Miscellaneous phytochemicals
Class
Not Available
Sub-class
Not Available

Spectra

No spectra information available

Food Sources

NameGroup
CarawayHerbs and Spices PublicationsShow
CarrotVegetables, Root vegetables PublicationsShow
CeleriacVegetables, Root vegetables PublicationsShow
Celery stalksVegetables, Other vegetables PublicationsShow
ChervilHerbs and Spices PublicationsShow
DillHerbs and Spices PublicationsShow
FennelHerbs and Spices PublicationsShow
ParsleyHerbs and Spices PublicationsShow
ParsnipVegetables, Root vegetables PublicationsShow

Metabolism

No metabolism information available

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