|
Entry |
|
|---|
|
Classification |
|
|---|
|
Carotenoid Name
|
2-Hydroxy-monocyclophytoene
|
|---|
|
IUPAC name |
7,8,11,12,7',8',11',12'-Octahydro-beta,psi-caroten-2-ol
|
|---|
|
Formula |
C40H64O
|
|---|
|
Molecular Weight |
560.912 g/mol
|
|---|
|
Structure |
Search similar carotenoids
Mol file
|
|---|
|
Carotenoid DB Fingerprints |
Predict biological activities of this carotenoid
7,8+H, 11,12+H, 7',8'+H, 11',12'+H, 2-OH, beta,psi
( Help )
|
|---|
|
Biological functions/Properties |
|
|---|
Number of
conjugated double bonds |
3
|
|---|
Number of
conjugated multiple bonds |
3
|
|---|
|
Isomers |
|
|---|
|
InChI |
|
|---|
|
InChIKey |
|
|---|
|
Canonical SMILES |
|
|---|
|
XLogP |
11.991
|
|---|
Hydrogen Bond donors
(Lipinski's definition) |
1
|
|---|
Hydrogen Bond Acceptors
(Lipinski's definition) |
1
|
|---|
| LipinskiFailures |
2
|
|---|
| Complexity of molecule |
0.057
|
|---|
| Number of heavy atoms |
41
|
|---|
TPSA
(Topological Polar Surface Area) |
20.230 Å2
|
|---|
|
Reaction |
|
|---|
|
Pathway |
|
|---|
|
Major carotenoid information |
|
|---|
|
Minor carotenoid information |
|
|---|
|
Source organisms |
|
|---|
|
References |
|
|---|
|
CAS |
-
|
|---|
|
Links to other DB |
|
|---|
|
