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Carotenoids DB          Carotenoids DB: CA00118   
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Entry
CA00118                                                            
Classification
Carotenoid Name
Lycopanerols J
IUPAC name Complex derivative of psi,psi-caroten
Formula
C122H238O8
Molecular Weight 
1833.124 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
0
Number of
conjugated multiple bonds 
0
Isomers 
  • Constitutional isomer: CA00114
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    54.430
    Hydrogen Bond donors
    (Lipinski's definition)
    1
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    8
    LipinskiFailures
    2
    Complexity of molecule
    0.060
    Number of heavy atoms
    130
    TPSA
    (Topological Polar Surface Area) 
    95.980 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Botryococcus braunii (Ref.65) - Green alga: Trebouxiophyceae (Chlorophyta - Botryococcaceae)
    References
  • Ref.65: Metzger, Pierre; Rager, Marie-Noeelle; Sellier, Nicole; Largeau, Claude, Journal of Natural Products (2003), 66(6), 772-778., "Lycopanerols I-​L, four new tetraterpenoid ethers from Botryococcus braunii".
    • CAS
    565430-10-6
    Links to other DB
    KNApSAcK: C00044897

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