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Entry
CA00912                                                            
Classification
Carotenoid Name
7',8',11',12'-Dehydrononaprenoxanthin
IUPAC name 2-(4-Hydroxy-3-methylbut-2-enyl)-epsilon,psi-carotene
Formula
C45H64O
Molecular Weight 
620.962 g/mol
Structure      Search similar carotenoids

Mol file
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Biological functions/Properties 
Number of
conjugated double bonds 
10
Number of
conjugated multiple bonds 
10
Isomers 
  • Constitutional isomer: CA00907, CA00908, CA00914
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    15.098
    Hydrogen Bond donors
    (Lipinski's definition)
    1
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    1
    LipinskiFailures
    2
    Complexity of molecule
    0.055
    Number of heavy atoms
    46
    TPSA
    (Topological Polar Surface Area) 
    20.230 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Cellulomonas dehydrogenans  - Actinobacteria (Actinobacteria - Cellulomonadaceae)
    References

    CAS
    26806-28-0
    Links to other DB

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