Entry |
|
Classification |
|
Carotenoid Name
|
3,4-Diketo-2',3'-dihydroxy-2-nor-beta-carotene
|
IUPAC name |
2',3'-Dihydroxy-2-nor-beta,beta-carotene-3,4-dione
|
Formula |
C39H50O4
|
Molecular Weight |
582.79 g/mol
|
Structure |
Search similar carotenoids

Mol file
|
Carotenoid DB Fingerprints |
|
Biological functions/Properties |
|
Number of conjugated double bonds |
13 including two ketones (13 in total)
|
Number of conjugated multiple bonds |
13 including two ketones (13 in total)
|
Isomers |
|
InChI |
|
InChIKey |
|
Canonical SMILES |
|
XLogP |
8.326
|
Hydrogen Bond donors (Lipinski's definition) |
2
|
Hydrogen Bond Acceptors (Lipinski's definition) |
4
|
LipinskiFailures |
1
|
Complexity of molecule |
0.312
|
Number of heavy atoms |
43
|
TPSA (Topological Polar Surface Area) |
74.600 Å2
|
Reaction |
|
Pathway |
|
Major carotenoid information |
|
Minor carotenoid information |
|
Source organisms |
|
References |
|
CAS |
28081-85-8
|
Links to other DB |
|
|