|
Entry |
|
|---|
|
Classification |
|
|---|
|
Carotenoid Name
|
(2S,5S,6R)-1,16-didehydro-2,6-cyclolycopene-5-ol;
(2S,5S,6R)-2,6-cyclolycopene-1,5-diol
|
|---|
|
IUPAC name |
(2S,5S,6R)-1,16-didehydro-2,6-cyclolycopene-psi,psi-carotene-5-ol
|
|---|
|
Formula |
C40H58O2
|
|---|
|
Molecular Weight |
570.864 g/mol
|
|---|
|
Structure |
Search similar carotenoids
Mol file
|
|---|
|
Carotenoid DB Fingerprints |
|
|---|
|
Biological functions/Properties |
|
|---|
Number of
conjugated double bonds |
10
|
|---|
Number of
conjugated multiple bonds |
10
|
|---|
|
Isomers |
Constitutional isomer: CA00084, CA00085, CA01056, CA00209, CA00224, CA00303, CA00334, CA00332, CA00482, CA00574, CA00617
|
|---|
|
InChI |
|
|---|
|
InChIKey |
|
|---|
|
Canonical SMILES |
|
|---|
|
XLogP |
11.937
|
|---|
Hydrogen Bond donors
(Lipinski's definition) |
2
|
|---|
Hydrogen Bond Acceptors
(Lipinski's definition) |
2
|
|---|
| LipinskiFailures |
2
|
|---|
| Complexity of molecule |
0.050
|
|---|
| Number of heavy atoms |
42
|
|---|
TPSA
(Topological Polar Surface Area) |
40.460 Å2
|
|---|
|
Reaction |
|
|---|
|
Pathway |
|
|---|
|
Major carotenoid information |
|
|---|
|
Minor carotenoid information |
|
|---|
|
Source organisms |
Solanum lycopersicum (Ref.318) - Land plant: Solanaceae: tomato, same as Lycopersicon esculentum (Streptophyta - Solanaceae)
|
|---|
|
References |
Ref.318: Tadashi YOKOTA, Hideo ETOH, Shunji OSHIMA, Kirou HAYAKAWA and Yukio ISHIGURO, Bioscience, Biotechnology, and Biochemistry, Volume 67, Issue 12, 2003, "Oxygenated Lycopene and Dehydrated Lutein in Tomato Puree".
|
|---|
|
CAS |
|
|---|
|
Links to other DB |
|
|---|
|
