Carotenoids obi
All carotenoids     All organisms     All pathways     All reactions     Feedback
Carotenoids DB          Carotenoids DB: CA01219   
[   About  |   Help  |   Search carotenoid entry  |   Search organism entry  |   Search similar carotenoids  |   Predict biological activities of this carotenoid  |   Search possible biosynthetic routes of this carotenoid   ]
Entry
CA01219                                                            
Classification
Carotenoid Name
Apo-12'-lycopenal
IUPAC name 12'-Apo-psi-caroten-12'-al
Formula
C25H34O
Molecular Weight 
350.522 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
  • Reduce the proliferation of prostate cancer cells by inhibiting normal cell cycle progression. (Ref.695)
    • Number of
    conjugated double bonds 
    8 including one aldehyde (8 in total)
    Number of
    conjugated multiple bonds 
    8 including one aldehyde (8 in total)
    Isomers 
  • Constitutional isomer: CA00844
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    7.830
    Hydrogen Bond donors
    (Lipinski's definition)
    0
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    1
    LipinskiFailures
    1
    Complexity of molecule
    0.000
    Number of heavy atoms
    26
    TPSA
    (Topological Polar Surface Area) 
    17.070 Å2
    Reaction
  • Product: CR00439
    • Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Homo sapiens (Ref.694)  - Mammal: Human (Chordata - Hominidae)
    Solanum lycopersicum (Ref.694) - Land plant: Solanaceae: tomato, same as Lycopersicon esculentum (Streptophyta - Solanaceae)
    Citrullus vulgaris (Ref.694) - Land plant: watermelon (Streptophyta - Cucurbitaceae)
    References
  • Ref.694: R. E. Kopec et al., J Agric Food Chem. 2010 March 24; 58(6), pp. 3290–3296, "Identification and Quantification of Apo-lycopenals in Fruits, Vegetables, and Human Plasma", doi:10.1021/jf100415z..
  • Ref.695: Ford NA, Elsen AC, Zuniga K, Lindshield BL, Erdman JW Jr., Nutr Cancer. 2011;63(2):256-63. "Lycopene and apo-12'-lycopenal reduce cell proliferation and alter cell cycle progression in human prostate cancer cells.", doi: 10.1080/01635581.2011.523494..
    • CAS
    103529-94-8
    Links to other DB

       Searching other references with Google Scholar or searching the colour of this carotenoid by Google image search