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Entry
CA00280                                                            

Classification
Carotenoid Name
4,4'-Diketo-γ-carotene;
4,4'-Diketo-gamma-carotene
IUPAC name beta,psi-Carotene-4,4'-dione
Formula
C40H52O2
Molecular Weight 
564.816 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
13 including one ketone (13 in total)
Number of
conjugated multiple bonds 
13 including one ketone (13 in total)
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
10.903
Hydrogen Bond donors
(Lipinski's definition)
0
Hydrogen Bond Acceptors
(Lipinski's definition)
2
LipinskiFailures
2
Complexity of molecule
0.064
Number of heavy atoms
42
TPSA
(Topological Polar Surface Area) 
34.140 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Myxococcus fulvus  - Deltaproteobacteria: halotolerant marine myxobacterium (Deltaproteobacteria - Myxococcaceae)
References

CAS
27404-52-0
Links to other DB
ProCarDB: C0671

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