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Carotenoids DB          Carotenoids DB: CA00369   
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Entry
CA00369                                                            

Classification
Carotenoid Name
Anhydrolutein III;
Deoxylutein I
IUPAC name (3R)-3',4'-Didehydro-beta,beta-caroten-3-ol
Formula
C40H54O
Molecular Weight 
550.832 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
12
Number of
conjugated multiple bonds 
12
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
12.535
Hydrogen Bond donors
(Lipinski's definition)
1
Hydrogen Bond Acceptors
(Lipinski's definition)
1
LipinskiFailures
1
Complexity of molecule
0.316
Number of heavy atoms
41
TPSA
(Topological Polar Surface Area) 
20.230 Å2
Reaction
  • Substrate: CR00078,  CR00100
  • Product: CR00231
  • Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References

    CAS
    752-29-4
    Links to other DB
    MassBank: CA000072

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