Carotenoids obi
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Entry
CA00795                                                            
Classification
Carotenoid Name
10'-Apolycopen-10'-oic acid;
apo-10'-lycopenoic acid
IUPAC name 10'-Apo-psi-caroten-10'-oic acid
Formula
C27H36O2
Molecular Weight 
392.558 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
  • Induce cell cycle arrest in cancer cells (Ref.415).
    • Number of
    conjugated double bonds 
    9 including one carboxylic acid (9 in total)
    Number of
    conjugated multiple bonds 
    9 including one carboxylic acid (9 in total)
    Isomers 
  • Constitutional isomer: CA00846, CA00847
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    8.654
    Hydrogen Bond donors
    (Lipinski's definition)
    1
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    2
    LipinskiFailures
    2
    Complexity of molecule
    0.000
    Number of heavy atoms
    29
    TPSA
    (Topological Polar Surface Area) 
    37.300 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References
  • Ref.415: Takuji Tanaka, Masahito Shnimizu, and Hisataka Moriwaki, Molecules 2012, 17, 3202-3242; doi:10.3390/molecules17033202, "Cancer Chemoprevention by Carotenoids".
    • CAS
    -
    Links to other DB

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