Carotenoids obi
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Carotenoids DB          Carotenoids DB: CA01181   
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Entry
CA01181                                                            
Classification
Carotenoid Name
IUPAC name 10-apo-19-nor-7,8-didehydro-epsilon-carotn-3,9-dione
Formula
C13H16O2
Molecular Weight 
204.258g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
  • An aroma compound identified in heather honey (Ref.623).
    • Number of
    conjugated double bonds 
    2
    Number of
    conjugated multiple bonds 
    4
    Isomers 
  • Constitutional isomer: CA01180
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    2.069
    Hydrogen Bond donors
    (Lipinski's definition)
    0
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    2
    LipinskiFailures
    0
    Complexity of molecule
    0.194
    Number of heavy atoms
    15
    TPSA
    (Topological Polar Surface Area) 
    34.140 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Apis mellifera (Ref.623) - Insect: honey bee (Arthropoda (Insecta) - Apidae)
    References
  • Ref.623: Peter Winterhalter and Russell Rouseff, ”Carotenoid-Derived Aroma Compounds: An Introduction”, ACS Symposium Series; American Chemical Society: Washington, DC, 2001., doi: 10.1021/bk-2002-0802.ch001.
    • CAS

    Links to other DB

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