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Entry
CA00784                                                            

Classification
Carotenoid Name
Didehydrotrikentriorhodin
IUPAC name 3,8-Dihydroxy-7',8'-didehydro-kappa,chi-caroten-6-one
Formula
C40H50O3
Molecular Weight 
578.8 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
9 and 3 including one ketone (12 in total)
Number of
conjugated multiple bonds 
13 including one ketone (13 in total)
Isomers 
  • Constitutional isomer: CA00297, CA00543, CA00483, CA00636, CA00735
  • InChI

    InChIKey

    Canonical SMILES

    XLogP
    12.384
    Hydrogen Bond donors
    (Lipinski's definition)
    2
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    3
    LipinskiFailures
    1
    Complexity of molecule
    0.323
    Number of heavy atoms
    43
    TPSA
    (Topological Polar Surface Area) 
    57.530 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References

    CAS
    -
    Links to other DB

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