Entry |
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Classification |
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Carotenoid Name
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IUPAC name |
(3R,2'S)-3,1'-Hydroxy-2'-(alpha-L-Fucosyl)-3',4'-didehydro-1',2'-dihydro-beta,psi-carotene-4-one
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Formula |
C46H64O8
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Molecular Weight |
768.992 g/mol
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Structure |
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Mol file
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Carotenoid DB Fingerprints |
Predict biological activities of this carotenoid
(3R,2'S), 3',4'--H, 1',2'+H, 3-OH, 1'-OH, 4=O, beta,psi, 2'-a-Lfuc
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Biological functions/Properties |
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Number of conjugated double bonds |
13 including one ketone (13 in total)
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Number of conjugated multiple bonds |
13 including one ketone (13 in total)
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Isomers |
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InChI |
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InChIKey |
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Canonical SMILES |
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XLogP |
9.539
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Hydrogen Bond donors (Lipinski's definition) |
5
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Hydrogen Bond Acceptors (Lipinski's definition) |
8
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LipinskiFailures |
2
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Complexity of molecule |
0.305
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Number of heavy atoms |
54
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TPSA (Topological Polar Surface Area) |
136.680 Å2
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Reaction |
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Pathway |
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Major carotenoid information |
Major carotenoid in Anabaena spp. and Nostoc sp. (Ref.732).
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Minor carotenoid information |
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Source organisms |
Nostoc sp. PCC 7120 (Ref.251) - Cyanobacteria: same as Anabaena sp. PCC 7120 (Cyanobacteria - Nostocaceae)
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References |
Ref.251: Mochimaru, Mari; Masukawa, Hajime; Maoka, Takashi; Mohamed, Hatem E.; Vermaas, Wim F. J.; Takaichi, Shinichi, Journal of Bacteriology (2008), 190(20), 6726-6733., "Substrate specificities and availability of fucosyltransferase and β-carotene hydroxylase for myxol 2'-fucoside synthesis in Anabaena sp. strain PCC 7120 compared with Synechocystis sp. strain PCC 6803". Ref.732: S. Takaichia and M. Mochimaru, Cell. Mol. Life Sci. 64 (2007) 2607 – 2619, "Carotenoids and carotenogenesis in cyanobacteria: unique ketocarotenoids and carotenoid glycosides", DOI 10.1007/s00018-007-7190-z.
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CAS |
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