Carotenoids obi
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Carotenoids DB          Carotenoids DB: CA01146   
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Entry
CA01146                                                            
Classification
Carotenoid Name
Acycloretinal
IUPAC name 15-Apo-psi-caroten-15-al
Formula
C20H28O
Molecular Weight 
284.424 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
6 in cluding an aldehyde (6 in total)
Number of
conjugated multiple bonds 
6 in cluding an aldehyde (6 in total)
Isomers 
  • Constitutional isomer: CA00807, CA01149, CA01139
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    6.261
    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
    21
    TPSA
    (Topological Polar Surface Area) 
    17.070 Å2
    Reaction
  • Substrate: CR00443
  • Product: CR00029,  CR00067,  CR00068,  CR00441
    • Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms

    References

    CAS

    Links to other DB

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