|
Entry |
|
|---|
|
Classification |
|
|---|
|
Carotenoid Name
|
Taraxien;
Taraxanthin dipalmitate;
Eloxanthin, dipalmitate
|
|---|
|
IUPAC name |
(3S,5R,6S,3'R,6'R)-5,6-Epoxy-3,3'-dihexadecanoyloxy-5,6-dihydro-beta,epsilon-carotene
|
|---|
|
Formula |
C72H116O5
|
|---|
|
Molecular Weight |
1061.648 g/mol
|
|---|
|
Structure |
Search similar carotenoids
Mol file
|
|---|
|
Carotenoid DB Fingerprints |
Predict biological activities of this carotenoid
(3S,5R,6S,3'R,6'R), 5,6+H, 5,6-Epoxy, beta,epsilon, 3-Hexadecanoyloxy, 3'-Hexadecanoyloxy
( Help )
|
|---|
|
Biological functions/Properties |
|
|---|
Number of
conjugated double bonds |
9
|
|---|
Number of
conjugated multiple bonds |
9
|
|---|
|
Isomers |
|
|---|
|
InChI |
|
|---|
|
InChIKey |
|
|---|
|
Canonical SMILES |
|
|---|
|
XLogP |
27.263
|
|---|
Hydrogen Bond donors
(Lipinski's definition) |
0
|
|---|
Hydrogen Bond Acceptors
(Lipinski's definition) |
5
|
|---|
| LipinskiFailures |
2
|
|---|
| Complexity of molecule |
0.161
|
|---|
| Number of heavy atoms |
77
|
|---|
TPSA
(Topological Polar Surface Area) |
65.130 Å2
|
|---|
|
Reaction |
|
|---|
|
Pathway |
|
|---|
|
Major carotenoid information |
|
|---|
|
Minor carotenoid information |
|
|---|
|
Source organisms |
|
|---|
|
References |
Ref.292: Thomas Wingerath ,Wilhelm Stahl ,Dieter Kirsch, Raimund Kaufmann, and Helmut Sies, J. Agric. Food Chem., 1996, 44 (8), pp 2006–2013, DOI: 10.1021/jf960057y, "Fruit Juice Carotenol Fatty Acid Esters and Carotenoids As Identified by Matrix-Assisted Laser Desorption Ionization (MALDI) Mass Spectrometry".
|
|---|
|
CAS |
10112-19-3
|
|---|
|
Links to other DB |
|
|---|
|
