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Entry
CA00282                                                            

Classification
Carotenoid Name
Salinixanthin;
1',2'-Dihydroxy-4-ketotorulene 1'-glucoside ester
IUPAC name ((all-E,2'S)-2'-hydroxy-1'-[6-O-(13-methyltetradecanoyl)-beta-D-glucopyranosyloxy]-3',4'-didehydro-1',2'-dihydro-beta,psi-caroten-4-one
Formula
C61H92O9
Molecular Weight 
969.346 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
13 including one ketone (13 in total)
Number of
conjugated multiple bonds 
13 including one ketone (13 in total)
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
16.713
Hydrogen Bond donors
(Lipinski's definition)
4
Hydrogen Bond Acceptors
(Lipinski's definition)
9
LipinskiFailures
2
Complexity of molecule
0.228
Number of heavy atoms
70
TPSA
(Topological Polar Surface Area) 
142.750 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Salinibacter ruber (Ref.358) - CFB group bacteria: extremely halophilic member of the Bacteria from saltern crystallizer ponds (Bacteroidetes - Rhodothermaceae)
References
  • Ref.358: Bjart Frode Lutnaes ,Aharon Oren ,and Synnøve Liaaen-Jensen, J. Nat. Prod., 2002, 65 (9), pp 1340–1343, DOI: 10.1021/np020125c, "New C40-Carotenoid Acyl Glycoside as Principal Carotenoid in Salinibacter ruber, an Extremely Halophilic Eubacterium".
  • CAS
    -
    Links to other DB
    LipidBank: VCA1110
    ProCarDB: C1436

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