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Entry
CA00319                                                            

Classification
Carotenoid Name
3,4,3',4'-Bisdehydro-β-carotene;
3,4,3',4'-Bisdehydro-beta-carotene
IUPAC name 3,4,3',4'-Tetradehydro-beta,beta-carotene
Formula
C40H52
Molecular Weight 
532.816 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
13
Number of
conjugated multiple bonds 
13
Isomers 
  • Constitutional isomer: CA00068, CA00704, CA00716, CA00722
  • InChI

    InChIKey

    Canonical SMILES

    XLogP
    14.506
    Hydrogen Bond donors
    (Lipinski's definition)
    0
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    0
    LipinskiFailures
    1
    Complexity of molecule
    0.326
    Number of heavy atoms
    40
    TPSA
    (Topological Polar Surface Area) 
    0.000 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Epicoccum nigrum (Ref.752) - Fungi: fungus, a plant pathogen (Ascomycota - Incertae sedis)
    References
  • Ref.752: F. H. Foppen, Olga Gribanovski-Sassu, Biochimica et Biophysica Acta 1969 176(2):357-66, "Carotenogenesis in diphenylamine-treated Epicoccum nigrum Link", DOI: 10.1016/0005-2760(69)90194-5.
  • CAS

    Links to other DB
    LipidBank: VCA0020

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