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Entry
CA00989                                                            
Classification
Carotenoid Name
Dihydroxylycopene diglucoside ester
IUPAC name 1-[(6-O-Acyl-beta-D-glucopyranosyl)oxy]-1'-beta-D-glucopyranosyloxy--1,2,1',2'-tetrahydro-psi,psi-carotene
Formula
C55H84O13
Molecular Weight 
953.222 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
11
Number of
conjugated multiple bonds 
11
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
10.718
Hydrogen Bond donors
(Lipinski's definition)
7
Hydrogen Bond Acceptors
(Lipinski's definition)
13
LipinskiFailures
4
Complexity of molecule
0.289
Number of heavy atoms
68
TPSA
(Topological Polar Surface Area) 
204.830 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Halorhodospira abdelmalekii (Ref.326) - purple sulfur bacteria (Gammaproteobacteria - Ectothiorhodospiraceae)
Halorhodospira halochloris (Ref.326) - purple sulfur bacteria (Gammaproteobacteria - Ectothiorhodospiraceae)
References
  • Ref.326: Shinichi Takaichi, Takashi Maoka, Satoshi Hanada, Johannes F. Imhoff, Archives of Microbiology, March 2001, Volume 175, Issue 3, pp 161-167, "Dihydroxylycopene diglucoside diesters: a novel class of carotenoids from the phototrophic purple sulfur bacteria Halorhodospira abdelmalekii and Halorhodospira halochloris".
    • CAS

    Links to other DB

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