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Entry
CA01239                                                            
Classification
Carotenoid Name
Violaxanthin laurate myristate
IUPAC name (3S,5R,6S,3'S,5'R,6'S)-5,6:5',6'-Diepoxy-5,6,5',6'-tetrahydro-beta,beta-carotene-3-laurate-3'-myristate
Formula
C66H104O6
Molecular Weight 
993.492 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
9
Number of
conjugated multiple bonds 
9
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
22.330
Hydrogen Bond donors
(Lipinski's definition)
0
Hydrogen Bond Acceptors
(Lipinski's definition)
6
LipinskiFailures
2
Complexity of molecule
0.182
Number of heavy atoms
72
TPSA
(Topological Polar Surface Area) 
77.660 Å2
Reaction
  • Substrate: CR00462
    • Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Malus domestica (Ref.778) - Land plant: Rosaceae: peel and flesh of apple fruits (Streptophyta - Rosaceae)
    References
  • Ref.778: Raúl Delgado-Pelayo, Lourdes Gallardo-Guerrero, Dámaso Hornero-Méndez, Food Research International 65:272, November 2014, “Chlorophyll and carotenoid pigments in the peel and flesh of commercial apple fruit varieties.”, DOI: 10.1016/j.foodres.2014.03.025.
    • CAS

    Links to other DB

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