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Carotenoids DB          Carotenoids DB: CA00382   
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Entry
CA00382                                                            
Classification
Carotenoid Name
3,5,6,3'-Tetrahydroxy-beta-carotene
IUPAC name 5,6-Dihydro-beta,beta-carotene-3,5,6,3'-tetrol
Formula
C40H58O4
Molecular Weight 
602.864 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
10
Number of
conjugated multiple bonds 
10
Isomers 
  • Constitutional isomer: CA01236, CA00612, CA00611
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    9.175
    Hydrogen Bond donors
    (Lipinski's definition)
    4
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    4
    LipinskiFailures
    1
    Complexity of molecule
    0.294
    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
    54899-36-4, 81601-85-6
    Links to other DB

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