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Carotenoids DB          Carotenoids DB: CA00275   
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Entry
CA00275                                                            
Classification
Carotenoid Name
1'-Hydroxy-4-keto-γ-carotene glucoside ester;
1'-OH-4-Keto-γ-carotene glucoside ester;
1'-Hydroxy-4-keto-gamma-carotene glucoside ester;
1'-OH-4-Keto-gamma-carotene glucoside ester
IUPAC name 1'-[(6-O-Acyl-beta-D-glucopyranosyl)oxy]-1',2'-dihydro-beta,psi-caroten-4-one
Formula
C50H72O8
Molecular Weight 
801.076 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
12 including one ketone (12 in total)
Number of
conjugated multiple bonds 
12 including one ketone (12 in total)
Isomers 
  • Constitutional isomer: CA00126
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    11.604
    Hydrogen Bond donors
    (Lipinski's definition)
    3
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    8
    LipinskiFailures
    2
    Complexity of molecule
    0.285
    Number of heavy atoms
    58
    TPSA
    (Topological Polar Surface Area) 
    122.520 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References

    CAS
    -
    Links to other DB
    LipidBank: VCA1092

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