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Entry
CA00621                                                            

Classification
Carotenoid Name
Helenien;
Lutein dipalmitate
IUPAC name (3R,3'R,6'R)-3,3'-Dihexadecanoyloxy-beta,epsilon-carotene
Formula
C72H116O4
Molecular Weight 
1045.648 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: CA00390
  • InChI

    InChIKey

    Canonical SMILES

    XLogP
    28.063
    Hydrogen Bond donors
    (Lipinski's definition)
    0
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    4
    LipinskiFailures
    2
    Complexity of molecule
    0.156
    Number of heavy atoms
    76
    TPSA
    (Topological Polar Surface Area) 
    52.600 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Helianthus annuus  - Land plant: sunflower (Streptophyta - Heliantheae)
    References

    CAS
    547-17-1
    Links to other DB
    KNApSAcK: C00003774

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