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Entry
CA00354                                                            

Classification
Carotenoid Name
3,4,3',4'-Tetrahydroxypirardixanthin
IUPAC name (3S,4R,5S,6S,3'S,4'R,5'S,6'S)-5,6,5',6'-Tetrahydro-beta,beta-carotene-3,4,3',4'-tetrol
Formula
C40H60O4
Molecular Weight 
604.88 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
9
Number of
conjugated multiple bonds 
9
Isomers 
  • Constitutional isomer: CA00787
  • InChI

    InChIKey

    Canonical SMILES

    XLogP
    11.128
    Hydrogen Bond donors
    (Lipinski's definition)
    4
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    4
    LipinskiFailures
    1
    Complexity of molecule
    0.288
    Number of heavy atoms
    44
    TPSA
    (Topological Polar Surface Area) 
    80.920 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References

    CAS
    98502-74-0
    Links to other DB
    KNApSAcK: C00022930

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