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Entry
CA00268                                                            

Classification
Carotenoid Name
Myxobactone;
all-trans-Myxobactone
IUPAC name 1'-(beta-D-Glucopyranosyloxy)-3',4'-didehydro-1',2'-dihydro-beta,psi-caroten-4-one
Formula
C46H64O7
Molecular Weight 
728.972 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
10.357
Hydrogen Bond donors
(Lipinski's definition)
4
Hydrogen Bond Acceptors
(Lipinski's definition)
7
LipinskiFailures
2
Complexity of molecule
0.316
Number of heavy atoms
53
TPSA
(Topological Polar Surface Area) 
116.450 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Cystobacter fuscus (Ref.216) - Deltaproteobacteria: myxobacterium (Deltaproteobacteria - Cystobacteraceae)
References
  • Ref.216: Eckau, H.; Dill, D.; Budzikiewicz, H., Zeitschrift fuer Naturforschung, C: Journal of Biosciences (1984), 39C(1-2), 1-9., "Novel ceramides from Cystobacter fuscus (Myxobacterales)".
  • CAS
    31679-77-3
    Links to other DB
    KNApSAcK: C00022992
    LipidBank: VCA1186

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