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Entry
CA00782                                                            
Classification
Carotenoid Name
Renieracistene
IUPAC name (7Z)-phi,chi-Carotene
Formula
C40H48
Molecular Weight 
528.784 g/mol
Structure      Search similar carotenoids

Mol file
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Biological functions/Properties 
Number of
conjugated double bonds 
15
Number of
conjugated multiple bonds 
15
Isomers 
  • Constitutional isomer: CA00771
  • Cis/trans isomer: CA00781
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    17.704
    Hydrogen Bond donors
    (Lipinski's definition)
    0
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    0
    LipinskiFailures
    1
    Complexity of molecule
    0.341
    Number of heavy atoms
    40
    TPSA
    (Topological Polar Surface Area) 
    0.000 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Tethya amamensis (Ref.183) - Sea sponge (Porifera - Tethyidae)
    References
  • Ref.183: Tanaka, Yoshito; Yamamoto, Atsushi; Katayama, Teruhisa, Nippon Suisan Gakkaishi (1982), 48(11), 1651-5., "Biochemical studies on the carotenoids in Porifera. Two natural 7-​cis aromatic carotenoids from sea sponge Tethya amamensis".
    • CAS
    84773-17-1
    Links to other DB

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